citronitrile (Symrise)
citronitrile (Symrise)

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  BOC Sciences

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  CODE123078 CODE123078
  Product(s):
  93893-89-1 3-Methyl-5-phenylpent-2-enenitrile

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  Lluch Essence S.L.

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  CITRONITRILE 94%

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  Moellhausen S.P.A.

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  After 50 years in business, Moellhausen stands out as one of the world’s leading family-run companies in the industry of flavors and fragrances, raw materials, and specialties.

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  106100 CITRONITRILE

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  Penta International Corporation

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  For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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  CODE123078 CODE123078
  Product(s):
  16-37700 5-PHENYL-3-METHYL-2-PENTENONITRILE

• 
  Symrise AG

  Always Insiring More
  Symrise aroma molecules & cosmetic ingredients for unique and innovative fragrances, flavors and cosmetics.
  We are globally recognized as a leading provider of fragrances, flavors and active ingredients as well as aroma chemicals for the perfume, cosmetic, pharmaceutical, food and beverage industries. We combine our knowledge about consumers’ ever- changing needs with creativity and ground-breaking technologies. In doing so, we concentrate on the development of solutions that provide our customers with added value. We ensure sustained value creation by allowing our employees and shareholders to share our Company’s success.
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  Product(s):
  611455 Citronitrile
  Stable in: body lotion (excellent), shampoo (excellent), soap (good), ap roll-on (very good), powder (very good), cleaner citric (very good), cleaner apc (very good), bleach (poor).

• 
  Vigon International

  Passion for Simplicity
  Manufacturer and supplier of high quality flavor and fragrance ingredients.
  The growth and success of Vigon is due in large part to a unique corporate concept that Vigon has developed and established within the industry: Creative Partnerships. This partnership concept has been and continues to be the foundation and guiding principle for all of Vigon's activities.
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  CODE123078 CODE123078
  Product(s):
  502472 Citronitrile

Fragrance Demo Formulas Name: 3-methyl-5-phenylpent-2-enenitrile CAS Number: 93893-89-1 3D/inchi ECHA EINECS - REACH Pre-Reg: 299-682-2 FDA UNII: Search MDL: MFCD00011718 XlogP3-AA: 3.30 (est) Molecular Weight: 171.24261000 Formula: C12 H13 N NMR Predictor: Predict (works with chrome, Edge or firefox) Category: fragrance agents   US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information: Google Scholar: Search Google Books: Search Google Scholar: with word "volatile" Search Google Scholar: with word "flavor" Search Google Scholar: with word "odor" Search Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.96800 @ 25.00 °C. Boiling Point: 309.00 to 311.00 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est) Flash Point: > 230.00 °F. TCC ( > 110.00 °C. ) logP (o/w): 3.345 (est) Soluble in:   alcohol   water, 43.83 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: citrus citrus lemongrass fruity floral rose cinnamon balsamic Odor Description:at 100.00 %. citrus lemongrass fruity floral rose cinnamon balsamic Luebke, William tgsc, (1986) Odor sample from: Harrmann & Reimer Corporation Odor and/or flavor descriptions from others (if found). Symrise Citronitrile Odor Description:citrus-like and fruity-floral with rosy and cinnamon nuances Stable in: body lotion (excellent), shampoo (excellent), soap (good), ap roll-on (very good), powder (very good), cleaner citric (very good), cleaner apc (very good), bleach (poor). Lluch Essence CITRONITRILE 94% Odor Description:CITRIC, FRESH, LEMONGRASS   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: BOC Sciences For experimental / research use only. 3-Methyl-5-phenylpent-2-enenitrile Lluch Essence CITRONITRILE 94% Odor: CITRIC, FRESH, LEMONGRASS Moellhausen CITRONITRILE Penta International 5-PHENYL-3-METHYL-2-PENTENONITRILE Sigma-Aldrich: Aldrich For experimental / research use only. Citronitrile sds Symrise Citronitrile Odor: citrus-like and fruity-floral with rosy and cinnamon nuances Use: Stable in: body lotion (excellent), shampoo (excellent), soap (good), ap roll-on (very good), powder (very good), cleaner citric (very good), cleaner apc (very good), bleach (poor). Vigon International Citronitrile Odor: Radiant citrussy note with fruity-floral nuances   Safety Information: Preferred SDS: View   Hazards identification   Classification of the substance or mixture GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) None found. GHS Label elements, including precautionary statements   Pictogram   Hazard statement(s) None found. Precautionary statement(s) None found. Oral/Parenteral Toxicity: Not determined Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice   Recommendation for citronitrile (Symrise) flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :104453 National Institute of Allergy and Infectious Diseases:Data 3-methyl-5-phenylpent-2-enenitrile Chemidplus:0093893891   References:   3-methyl-5-phenylpent-2-enenitrile NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 93893-89-1 Pubchem (cid): 104453 Pubchem (sid): 44434101   Other Information: (IUPAC): Atomic Weights of the Elements 2011 (pdf) Videos: The Periodic Table of Videos tgsc: Atomic Weights use for this web site (IUPAC): Periodic Table of the Elements HMDB (The Human Metabolome Database): Search Export Tariff Code: 2926.90.4400 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these cymbopogon citratus dc. stapf. oil cuba FR aldehydic aldehydic 6,7,8- decen-1-ol FR (Z)-4- dodecenal FL/FR 2- methyl undecanal dimethyl acetal FR 3- methyl-4-hexyl oxybutyraldehyde FR nonanal diethyl acetal FL/FR balsamic cinnamyl formate FL/FR camphoreous fenchol FL/FR chocolate iso amyl phenyl acetate FL/FR citrus abronia fragrance FR acetaldehyde citronellyl methyl acetal FR aldehydic nitrile FR beta- bisabolol FL/FR cedrat peel oil FL/FR citral FL/FR citral / methyl anthranilate schiff's base FR citral diethyl acetal FL/FR citral dimethyl acetal FL/FR citral ethylene glycol acetal FR citral propylene glycol acetal FL/FR citronella oil ceylon FL/FR (R)- citronellyl nitrile FR citronellyl nitrile FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-yl acetate FL/FR 2- dodecanone FL/FR homo geranyl nitrile FR 2- heptanol FL/FR lemon hexadiene FL/FR lemon oil c.p. california FL/FR lemon oil c.p. furocoumarin reduced FL/FR lemon oil italy FL/FR lemon oil terpeneless FL/FR lemongrass oil FL/FR lemongrass oil guatemala FL/FR lemongrass oil morocco FL/FR litsea cubeba fruit oil FL/FR litsea cubeba oil terpeneless FL/FR methyl heptenone FL/FR (Z+E)-2- methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde FL/FR 1- methyl-4-methyl ethenyl cyclohexene sulfurized FL/FR neroli ketone FR ocimenol FL/FR petitgrain combava oil FR (Z)-8- tetradecenal FL/FR tetrahydrocitral FL/FR trimethyl cyclohexene FR verbena oil spain FL/FR verbena oil terpeneless FL/FR creamy 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR fatty butyl undecylenate FL/FR fermented methyl decanoate FL/FR floral acetal 318 FR iso amyl angelate FL/FR alpha- amyl cinnamaldehyde dimethyl acetal FL/FR iso amyl geranate FR iso amyl undecylenate FL/FR benzyl acetate FL/FR benzyl acetoacetate FL/FR benzyl alcohol FL/FR benzyl isobutyrate FL/FR blue lagoon fragrance FR bursera graveolens wood oil FL/FR laevo- citronellol FL/FR (S)- citronellyl acetate FL/FR citronellyl acetate FL/FR citronellyl anthranilate FL/FR citronellyl butyrate FL/FR citronellyl hexanoate FL/FR (E)- citronellyl tiglate FL/FR 3- cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester FR cymbopogon validus leaf oil FR gamma- damascone FR (Z)-alpha- damascone FL/FR dimethyl benzyl carbinyl acetate FL/FR 3,6- dimethyl-3-octyl acetate FR ethyl anthranilate FL/FR ethyl ethyl anthranilate FL/FR ethyl phenoxyacetate FR eucalyptus macarthurii oil FR farnesyl acetate FL/FR floral pyran FR geraniol FL/FR geranium oil egypt FL/FR geranium oil egypt fractions FR geranium oil terpeneless FL/FR geranium petiole oil india FL/FR geranium rose oil FL/FR geranium rose-scented oil cuba FR geranyl acetate FL/FR geranyl isobutyrate FL/FR (E)- geranyl linalool FL/FR geranyl tiglate FL/FR glycoacetal FR hawthorn ethanol FR hibiscus fragrance FR ionone mixed isomers FL/FR jasmin cyclopentanone FR iso jasmone FL/FR lemon oil distilled FL/FR linalyl butyrate FL/FR magnolia flower oil CO2 extract FL/FR magnolia specialty FR menthadienyl formate FR ortho- methoxybenzyl ethyl ether FR methoxymelonal FL/FR 1-(2- methyl allyl oxy)-3-methoxy-3-methyl-1-butane FR para- methyl benzyl acetate FL/FR methyl benzyl acetate (mixed ortho-,meta-,para-) FL/FR alpha-iso methyl ionone (90% min.) FL/FR methyl ionyl acetate FL/FR 2- methyl octanal FL/FR musk acetate FR pink nelumbo nucifera flower absolute FR white nelumbo nucifera flower absolute FR white nelumbo nucifera flower concrete FR neryl acetate FL/FR neryl isovalerate FL/FR nonanol FL/FR 3- nonanon-1-yl acetate FL/FR octyl isovalerate FL/FR orris rhizome concrete butter (iris pallida) FL/FR osmanthus absolute replacer FR osmanthus concrete FL/FR peony alcohol FR petitgrain mandarin oil FL/FR phenethyl alcohol FL/FR phenethyl anthranilate FL/FR phenethyl heptanoate FL/FR phenethyl isobutyrate FL/FR phenethyl isovalerate FL/FR phenethyl lactate FL/FR phenethyl salicylate FL/FR phenyl acetaldehyde digeranyl acetal FR phenyl amyl alcohol FL/FR 1- phenyl propyl butyrate FL/FR 2- phenyl propyl isobutyrate FL/FR 4- phenyl-3-buten-2-ol FL/FR primrose fragrance FR iso propyl benzoate FL/FR rhodinol substitues FL/FR rhodinyl acetate substitutes FL/FR rhodinyl butyrate FL/FR rosa alba flower oil CO2 extract FR rose absolute (rosa centifolia) FL/FR rose absolute (rosa centifolia) morocco FL/FR rose absolute (rosa damascena) bulgaria FL/FR rose absolute (rosa damascena) turkey FL/FR rose absolute pentanol FR rose acetate FR rose blossom pentanol FR rose butanoate FL/FR rose concrete (rosa centifolia) FR rose concrete (rosa damascena) FR rose oil (rosa centifolia) egypt FL/FR rose oil (rosa damascena) bulgaria FL/FR rose oil (rosa damascena) iran FL/FR rose oil (rosa damascena) turkey FL/FR rose oil replacer FR rose pyran FR rose undecene FR souroubea specialty FR star fruit oil cuba FL/FR styralyl propionate FL/FR terpinyl formate FL/FR terpinyl valerate FL/FR tetrahydroionyl acetate FR (E)-2,5,9- trimethyl-4,9-decadien-1-al FR 2- undecen-1-ol FL/FR (E)-2- undecen-1-ol FL/FR fruity allyl benzoate FR iso amyl 2-methyl butyrate FL/FR amyl heptanoate FL/FR apricot essence FL/FR benzaldehyde / methyl anthranilate schiff's base FR benzyl propionate FL/FR benzyl valerate FL/FR berry hexanoate FR iso butyl 2-methyl butyrate FL/FR butyl 2-naphthyl ether FL/FR iso butyl furyl propionate FL/FR citronellyl isobutyrate FL/FR (Z)-beta- damascone FL/FR (E)-beta- damascone FL/FR (E)-alpha- damascone FL/FR beta- damascone FL/FR (R)-gamma- dodecalactone FL/FR eriocephalus punctulatus flower oil FR ethyl citronellate FL/FR ethyl isobutyrate FL/FR ethyl para-methyl-beta-phenyl glycidate FR ginsene FR heptanal cyclic ethylene acetal FR linalool oxide acetates FL/FR 3- mercaptohexyl acetate FL/FR methyl acetoacetate FL/FR methyl bicycloheptenyl methyloxirane carboxylate FR methyl isobutyrate FL/FR (E)-7- methyl-3-octen-2-one FL/FR (±)-3- methyl-gamma-decalactone FL/FR myrascone FR 2- nonanone propylene glycol acetal FL/FR alpha- ocimene FL/FR peach nitrile FR plum crotonate FR plum damascone (high alpha) FR iso propyl isobutyrate FL/FR sambucus canadensis fruit absolute FL/FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR (R)- styralyl acetate FL/FR 4-(para- tolyl)-2-butanone FL/FR tropical specialty FR (E)-2- undecenal FL/FR cis- woody acetate FR green iso amyl 3-(2-furan) propionate FL/FR citrus carbaldehyde / methyl anthranilate schiff's base FR iso decanal FL/FR green carboxylate FR 2- heptyl tetrahydrofuran FR dextro- limonene oxide FL/FR (2- methoxy-1-methyl butyl) benzene FR [(4E,4Z)-5- methoxy-3-methyl-4-penten-1-yl] benzene FR phenyl acetaldehyde dimethyl acetal FL/FR 1-[(3aS,7aR)-3a,4,7,7a- tetrahydro-1H-inden-6-yl]ethanone FR herbal canarium luzonicum gum FL/FR canarium luzonicum oil FL/FR chamomile isobutyrate FR chamomile propionate FR chamomile valerate FR 2- dodecenal FL/FR geranium cyclohexane FR laevo- menthyl propionate FL/FR 6- methoxy-2,6-dimethyl octanal FR methyl cyclogeranate (Firmenich) FR (1S,5R)- myrtenyl acetate FL/FR rose oil (rosa centifolia) morocco FL/FR tagete oil madagascar FL/FR medicinal ortho- cresyl acetate FL/FR powdery para- anisyl alcohol FL/FR alpha- methyl ionone FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR spicy maja fragrance FR pepper hexanone FR spicy acetoacetate FL/FR terpenic elemi resinoid FL/FR gamma- terpinene FL/FR tropical triflaige A (ZEON) FR waxy 3- decanone FL/FR dihydrocitronellyl acetate FL/FR (E)- methyl geranate FL/FR phytyl acetate FL/FR woody 2- decalinyl acetate FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR melozol acetate FR rhubarb oxirane FR alpha- terpinene FL/FR For Flavor No flavor group found for these iso amyl angelate FL/FR alpha- amyl cinnamaldehyde dimethyl acetal FL/FR iso amyl undecylenate FL/FR benzyl valerate FL/FR bursera graveolens wood oil FL/FR butyl 2-naphthyl ether FL/FR cedrat peel oil FL/FR citral propylene glycol acetal FL/FR ortho- cresyl acetate FL/FR beta- cubebene FL (Z)-alpha- damascone FL/FR iso decanal FL/FR 3- decanone FL/FR dihydrocitronellyl acetate FL/FR dihydronootkatone FL (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-yl acetate FL/FR (R)-gamma- dodecalactone FL/FR (Z)-4- dodecenal FL/FR epoxy-2-decenal FL ethyl ethyl anthranilate FL/FR (E)- geranyl linalool FL/FR ionone mixed isomers FL/FR linalool oxide acetates FL/FR magnolia flower oil CO2 extract FL/FR laevo- menthyl propionate FL/FR 4- mercapto-4-methyl-2-pentanol FL methyl acetoacetate FL/FR methyl benzyl acetate (mixed ortho-,meta-,para-) FL/FR (E)- methyl geranate FL/FR 2- methyl octanal FL/FR (Z+E)-2- methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde FL/FR nonanal diethyl acetal FL/FR 2- nonanone propylene glycol acetal FL/FR alpha- ocimene FL/FR ocimenol FL/FR octyl isovalerate FL/FR phenethyl heptanoate FL/FR phenethyl lactate FL/FR phenyl amyl alcohol FL/FR 1- phenyl propyl butyrate FL/FR 2- phenyl propyl isobutyrate FL/FR iso propyl benzoate FL/FR iso propyl isobutyrate FL/FR rhodinyl acetate substitutes FL/FR (R)- styralyl acetate FL/FR (Z)-8- tetradecenal FL/FR tetrahydrocitral FL/FR (E)-2- undecen-1-ol FL/FR 2- undecen-1-ol FL/FR iso amyl 3-(2-furan) propionate FL/FR benzyl acetoacetate FL/FR iso butyl furyl propionate FL/FR beta- damascone FL/FR dextro- limonene oxide FL/FR berry berry rhodinol substitues FL/FR camphoreous fenchol FL/FR citrus beta- bisabolol FL/FR citral FL/FR citral diethyl acetal FL/FR citral dimethyl acetal FL/FR citronella oil ceylon FL/FR dehydronootkatone FL lemon hexadiene FL/FR lemon oil c.p. california FL/FR lemon oil c.p. furocoumarin reduced FL/FR lemon oil distilled FL/FR lemon oil italy FL/FR lemon oil terpeneless FL/FR lemongrass oil FL/FR lemongrass oil guatemala FL/FR lemongrass oil morocco FL/FR litsea cubeba fruit oil FL/FR 1- methyl-4-methyl ethenyl cyclohexene sulfurized FL/FR petitgrain mandarin oil FL/FR styralyl propionate FL/FR verbena oil spain FL/FR verbena oil terpeneless FL/FR dusty ethyl citronellate FL/FR ethereal ethyl isobutyrate FL/FR methyl isobutyrate FL/FR fatty 2- dodecanone FL/FR 2- dodecenal FL/FR methyl decanoate FL/FR (E)-7- methyl-3-octen-2-one FL/FR floral iso amyl phenyl acetate FL/FR laevo- citronellol FL/FR (S)- citronellyl acetate FL/FR citronellyl acetate FL/FR citronellyl hexanoate FL/FR dimethyl benzyl carbinyl acetate FL/FR farnesyl acetate FL/FR geraniol FL/FR geranium oil egypt FL/FR geranium oil terpeneless FL/FR geranium petiole oil india FL/FR geranium rose oil FL/FR geranyl isobutyrate FL/FR geranyl tiglate FL/FR linalyl butyrate FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR alpha-iso methyl ionone (90% min.) FL/FR neryl acetate FL/FR orris rhizome concrete butter (iris pallida) FL/FR phenethyl alcohol FL/FR phenethyl anthranilate FL/FR rhodinyl butyrate FL/FR rose absolute (rosa centifolia) FL/FR rose absolute (rosa centifolia) morocco FL/FR rose absolute (rosa damascena) bulgaria FL/FR rose absolute (rosa damascena) turkey FL/FR rose oil (rosa centifolia) egypt FL/FR rose oil (rosa damascena) bulgaria FL/FR rose oil (rosa damascena) iran FL/FR rose oil (rosa damascena) turkey FL/FR fruity iso amyl 2-methyl butyrate FL/FR amyl heptanoate FL/FR para- anisyl alcohol FL/FR apricot essence FL/FR benzyl acetate FL/FR benzyl alcohol FL/FR benzyl isobutyrate FL/FR benzyl propionate FL/FR iso butyl 2-methyl butyrate FL/FR citronellyl anthranilate FL/FR citronellyl butyrate FL/FR citronellyl isobutyrate FL/FR (Z)-beta- damascone FL/FR (E)-alpha- damascone FL/FR (E)-beta- damascone FL/FR ethyl anthranilate FL/FR 2- heptanol FL/FR 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR methoxymelonal FL/FR para- methyl benzyl acetate FL/FR alpha- methyl ionone FL/FR neryl isovalerate FL/FR 3- nonanon-1-yl acetate FL/FR osmanthus concrete FL/FR phenethyl isovalerate FL/FR rose butanoate FL/FR sambucus canadensis fruit absolute FL/FR star fruit oil cuba FL/FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR tagete oil madagascar FL/FR terpinyl formate FL/FR terpinyl valerate FL/FR 4-(para- tolyl)-2-butanone FL/FR green canarium luzonicum gum FL/FR canarium luzonicum oil FL/FR (E)- citronellyl tiglate FL/FR elemi resinoid FL/FR geranyl acetate FL/FR iso jasmone FL/FR methyl heptenone FL/FR phenyl acetaldehyde dimethyl acetal FL/FR herbal rose oil (rosa centifolia) morocco FL/FR honey phenethyl isobutyrate FL/FR lemon litsea cubeba oil terpeneless FL/FR medicinal, phenethyl salicylate FL/FR nutty phytyl acetate FL/FR spicy cinnamyl formate FL/FR spicy acetoacetate FL/FR terpenic alpha- terpinene FL/FR gamma- terpinene FL/FR tropical 3- mercaptohexyl acetate FL/FR waxy butyl undecylenate FL/FR (±)-3- methyl-gamma-decalactone FL/FR nonanol FL/FR 4- phenyl-3-buten-2-ol FL/FR (E)-2- undecenal FL/FR woody methyl ionyl acetate FL/FR (1S,5R)- myrtenyl acetate FL/FR   Potential Uses: FR abronia FR ash mountain ash berry FR bergamot FR calamus oil replacer FR cedrat FL/FR cilantro FR citronella FR citrus FR cologne FR colonia FR curacao FR ginger FR grapefruit FR kumquat FR lemon FR lemongrass FR lime FL/FR litsea cubeba FR mandarin FR melissa oil replacer FR mock orange FL nectarine FR orange FL/FR orange bitter orange peel FR rhubarb FR tangerine FR verbena   Occurrence (nature, food, other):note   not found in nature   Synonyms:   citronitrile (Symrise)   citrus nitrile 3- methyl-5-phenyl pent-2-ene nitrile 3- methyl-5-phenyl-2-pentene nitrile 3- methyl-5-phenyl-2-pentenenitrile 3- methyl-5-phenyl-pent-2-enenitrile 3- methyl-5-phenylpent-2-enenitrile 2- pentenenitrile, 3-methyl-5-phenyl- 5- phenyl-3-methyl-2-pentenonitrile   Articles:   None found yet. Try the PubMed Search.

Notes: Like citralva but longer lasting. Citral replacer.