Category:flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
Appearance: | colorless clear liquid (est) |
Assay: | 95.00 to 100.00
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Food Chemicals Codex Listed: | No |
Specific Gravity: | 0.82200 to 0.83200 @ 20.00 °C.
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Pounds per Gallon - (est).: | 6.848 to 6.931
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Refractive Index: | 1.41100 to 1.41700 @ 20.00 °C.
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Boiling Point: | 210.00 °C. @ 760.00 mm Hg
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Boiling Point: | 70.00 °C. @ 2.50 mm Hg
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Acid Value: | 1.00 max. KOH/g
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Vapor Pressure: | 0.238000 mmHg @ 25.00 °C. (est) |
Flash Point: | 121.00 °F. TCC ( 49.50 °C. ) (est)
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logP (o/w): | 3.767 (est) |
Soluble in: |
| alcohol | | water, 16.19 mg/L @ 25 °C (est) |
Insoluble in: |
| water |
Similar Items:note |
acetaldehyde diamyl acetal |
3-methyl-1-[1-(3-methylbutoxy)ethoxy]butane |
Organoleptic Properties:
Odor Type: fruity |
alcoholic fruity ethereal green fermented |
Odor Description:at 10.00 % in dipropylene glycol. alcoholic fruity ethereal green fermented |
Odor and/or flavor descriptions from others (if found). |
Cosmetic Information:
Suppliers:
Safety Information:
European information : |
Most important hazard(s): | Xi - Irritant |
R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
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Hazards identification |
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Classification of the substance or mixture |
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
None found. |
GHS Label elements, including precautionary statements |
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Pictogram | |
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Hazard statement(s) |
None found. |
Precautionary statement(s) |
None found. |
Oral/Parenteral Toxicity: |
Not determined
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Dermal Toxicity: |
Not determined
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Inhalation Toxicity: |
Not determined
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Safety in Use Information:
Category: | flavor and 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 acetaldehyde diisoamyl acetal usage levels up to: | | 2.0000 % in the fragrance concentrate.
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Maximised Survey-derived Daily Intakes (MSDI-EU): | 14.00 (μg/capita/day) |
Modified Theoretical Added Maximum Daily Intake (mTAMDI): | 1600 (μg/person/day) |
Threshold of Concern: | 1800 (μg/person/day) |
Structure Class: | I |
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). |
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library |
publication number: 21 |
Click here to view publication 21 |
| average usual ppm | average maximum ppm |
baked goods: | 25.00000 | 50.00000 |
beverages(nonalcoholic): | 10.00000 | 20.00000 |
beverages(alcoholic): | 10.00000 | 20.00000 |
breakfast cereal: | - | - |
cheese: | - | - |
chewing gum: | - | - |
condiments / relishes: | - | - |
confectionery froastings: | - | - |
egg products: | - | - |
fats / oils: | - | - |
fish products: | 10.00000 | 20.00000 |
frozen dairy: | 15.00000 | 30.00000 |
fruit ices: | 10.00000 | 20.00000 |
gelatins / puddings: | 15.00000 | 30.00000 |
granulated sugar: | - | - |
gravies: | - | - |
hard candy: | 20.00000 | 40.00000 |
imitation dairy: | - | - |
instant coffee / tea: | - | - |
jams / jellies: | - | - |
meat products: | - | - |
milk products: | 10.00000 | 20.00000 |
nut products: | - | - |
other grains: | - | - |
poultry: | - | - |
processed fruits: | - | - |
processed vegetables: | - | - |
reconstituted vegetables: | - | - |
seasonings / flavors: | 10.00000 | 20.00000 |
snack foods: | 10.00000 | 20.00000 |
soft candy: | 15.00000 | 30.00000 |
soups: | 15.00000 | 30.00000 |
sugar substitutes: | - | - |
sweet sauces: | - | - |
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Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). |
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm. |
| average usage mg/kg | maximum usage mg/kg |
Dairy products, excluding products of category 02.0 (01.0): | 3.00000 | 15.00000 |
Fats and oils, and fat emulsions (type water-in-oil) (02.0): | 2.00000 | 10.00000 |
Edible ices, including sherbet and sorbet (03.0): | 3.00000 | 15.00000 |
Processed fruit (04.1): | 2.00000 | 10.00000 |
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): | - | - |
Confectionery (05.0): | 4.00000 | 20.00000 |
Chewing gum (05.3): | - | - |
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): | 2.00000 | 10.00000 |
Bakery wares (07.0): | 5.00000 | 25.00000 |
Meat and meat products, including poultry and game (08.0): | 1.00000 | 5.00000 |
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): | 1.00000 | 5.00000 |
Eggs and egg products (10.0): | - | - |
Sweeteners, including honey (11.0): | - | - |
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): | 2.00000 | 10.00000 |
Foodstuffs intended for particular nutritional uses (13.0): | 3.00000 | 15.00000 |
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): | 2.00000 | 10.00000 |
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): | 4.00000 | 20.00000 |
Ready-to-eat savouries (15.0): | 5.00000 | 25.00000 |
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): | 2.00000 | 10.00000 |
Safety References:
European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
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European Food Safety Authority (EFSA) reference(s):
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Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 3 (FGE.03); Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes, and a orthoester of formic acid, from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf
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Flavouring Group Evaluation 3, Revision 1 (FGE.03Rev1): Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated or unsaturated aldehydes, an ester of a hemiacetal and an orthoester of formic acid, from chemical groups 1, 2 & 4 Commission Regulation (EC) No 1565/2000 of 18 July 2000) [1] - Scientific Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)on a request from the Commission View page or View pdf
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Flavouring Group Evaluation 61 (FGE.61): Consideration of aliphatic acyclic acetals evaluated by JECFA (57th meeting) structurally related to acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes, and an orthoester of formic acid evaluated by EFSA in FGE.03 (2004) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf
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Flavouring Group Evaluation 61, Revision 1 (FGE.61Rev1): Consideration of aliphatic acetals evaluated by JECFA (57th meeting) structurally related to acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated aldehydes and one orthoester of formic acid evaluated View page or View pdf
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Scientific Opinion on Flavouring Group Evaluation 3, Revision 2 (FGE.03Rev2): Acetals of branched- and straight-chain aliphatic saturated primary alcohols and branched- and straight-chain saturated or unsaturated aldehydes, an ester of a hemiacetal and an orthoester of formic acid, from chemical groups 1, 2 and 4 View page or View pdf
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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 :83036 |
National Institute of Allergy and Infectious Diseases:Data |
3-methyl-1-[1-(3-methylbutoxy)ethoxy]butane |
Chemidplus:0013002090 |
References:
Other Information:
Potential Blenders and core components note
For Odor |
alcoholic |
fusel oil FL/FR |
balsamic |
iso amyl benzoate FL/FR |
opoponax resinoid (balsamodendron kafal) FR |
terpinyl cinnamate FL/FR |
caramellic |
diethyl malate FL/FR |
maltyl isobutyrate FL/FR |
chemical |
iso butyl formate FL/FR |
citrus |
2- heptanol FL/FR |
earthy |
amyl octanoate FL/FR |
ethereal |
acetal FL/FR |
iso amyl acetoacetate FL/FR |
butyl acetate FL/FR |
iso butyl alcohol FL/FR |
cyclohexyl formate FL/FR |
ethyl 4-pentenoate FL/FR |
ethyl acetate FL/FR |
ethyl formate FL/FR |
ethyl pyruvate FL/FR |
1- hexen-3-ol FL/FR |
methyl acetate FL/FR |
methyl ethyl ketone FL/FR |
2- methyl valeraldehyde FL/FR |
2- methyl-1-butanol FL/FR |
iso propyl acetate FL/FR |
propyl formate FL/FR |
propyl valerate FL/FR |
iso valeraldehyde propylene glycol acetal FL/FR |
fatty |
butyl undecylenate FL/FR |
methyl (E)-2-hexenoate FL/FR |
fermented |
methyl decanoate FL/FR |
3- methyl-1-pentanol FL/FR |
2- pentanol FL/FR |
floral |
butyl tiglate FR |
dimethyl anthranilate FL/FR |
nonan-3-yl acetate FL/FR |
phenethyl acetate FL/FR |
fruity |
acetaldehyde dihexyl acetal FL/FR |
allyl amyl glycolate FR |
allyl butyrate FL/FR |
amyl acetate FL/FR |
iso amyl butyrate FL/FR |
amyl formate FL/FR |
amyl heptanoate FL/FR |
iso amyl isovalerate FL/FR |
iso amyl octanoate FL/FR |
benzyl methyl ether FL/FR |
iso butyl acetate FL/FR |
iso butyl acetoacetate FL/FR |
butyl anthranilate FL/FR |
butyl hexanoate FL/FR |
butyl isobutyrate FL/FR |
iso butyl propionate FL/FR |
iso butyl valerate FL/FR |
cherry pentenoate FL/FR |
2- cyclopentyl cyclopentanone FL/FR |
diethyl laevo-tartrate FL/FR |
diethyl malonate FL/FR |
diethyl sebacate FL/FR |
dimethyl succinate FL/FR |
ethyl 2-cyclohexyl propionate FR |
ethyl 2-octenoate FL/FR |
ethyl 3-acetoxyhexanoate FL/FR |
ethyl 3,5,5-trimethyl hexanoate FR |
ethyl acetoacetate FL/FR |
2- ethyl butyl acetate FL/FR |
ethyl heptanoate FL/FR |
ethyl propionate FL/FR |
farnesyl acetone FL/FR |
geranyl acetoacetate FL/FR |
geranyl ethyl ether FL/FR |
heptanal cyclic ethylene acetal FR |
2- hexen-1-ol FL/FR |
(E)-3- hexen-1-yl acetate FL/FR |
(Z)-3- hexen-1-yl isobutyrate FL/FR |
hexyl (E)-tiglate FL/FR |
hexyl acetate FL/FR |
methyl 2-methyl butyrate FL/FR |
methyl 3-nonenoate FL/FR |
2- methyl butyl 2-methyl butyrate FL/FR |
methyl butyrate FL/FR |
methyl heptanoate FL/FR |
methyl hexanoate FL/FR |
methyl isobutyrate FL/FR |
methyl nonanoate FL/FR |
nerolidyl isobutyrate FR |
octen-1-yl cyclopentanone FL/FR |
octyl butyrate FL/FR |
2- pentanone FL/FR |
2- pentyl furan FL/FR |
pineapple pentenoate FL/FR |
prenol FL/FR |
prenyl ethyl ether FL/FR |
prenyl hexanoate FL/FR |
iso propyl 2-methyl butyrate FL/FR |
iso propyl butyrate FL/FR |
propyl heptanoate FL/FR |
propyl isobutyrate FL/FR |
iso propyl propionate FL/FR |
rhubarb undecane FR |
sorbyl butyrate FL/FR |
tetrahydrofurfuryl butyrate FL/FR |
tropical indene FR |
tropical thiazole FL/FR |
green |
iso amyl formate FL/FR |
benzaldehyde dimethyl acetal FL/FR |
cognac heptanone FL/FR |
green cognac oil FL/FR |
alpha- decalactone FL/FR |
ethyl (E,Z)-2,4-decadienoate FL/FR |
heptanal dimethyl acetal FL/FR |
(Z)-3- hexen-1-yl butyrate FL/FR |
(E)-2- hexen-1-yl formate FL/FR |
(E)-2- hexen-1-yl hexanoate FL/FR |
(Z)-3- hexen-1-yl hexanoate FL/FR |
hexyl isobutyrate FL/FR |
hexyl octanoate FL/FR |
hexyl phenyl acetate FL/FR |
manzanate (Givaudan) FL/FR |
(Z)-2- penten-1-ol FL/FR |
phenoxyethyl isobutyrate FL/FR |
propylene acetal FL/FR |
tiglaldehyde FL/FR |
violet dienyne FR |
herbal |
iso amyl tiglate FL/FR |
white cognac oil FL/FR |
ethyl chrysanthemate FR |
hexanol FL/FR |
phenethyl senecioate FL/FR |
viridiflorol FL/FR |
honey |
methyl hydrocinnamate FL/FR |
sulfurous |
buchu mercaptan FL/FR |
cassis pentanone FL/FR |
passiflora acetate FL/FR |
tropical |
beta- cyclocitral FL/FR |
waxy |
allyl nonanoate FL/FR |
iso amyl laurate FL/FR |
ethyl nonanoate FL/FR |
ethyl octanoate FL/FR |
octyl 2-methyl butyrate FL/FR |
winey |
butyl angelate FL/FR |
2- hexanol FL/FR |
woody |
verdoxan FR |
For Flavor |
No flavor group found for these |
acetaldehyde 1,3-octane diol acetal FL |
4- acetyl-2-isopropenyl pyridine FL |
amyl octanoate FL/FR |
iso amyl tiglate FL/FR |
2- amyl-5 or 6-keto-1,4-dioxane FL |
butyl angelate FL/FR |
butyl methyl ketone FL |
iso butyraldehyde propylene glycol acetal FL |
2- cyclopentyl cyclopentanone FL/FR |
alpha- decalactone FL/FR |
diethyl laevo-tartrate FL/FR |
diethyl malate FL/FR |
ethyl 2-methyl-2-(methyl thio) propionate FL |
ethyl 3-acetoxyhexanoate FL/FR |
ethyl 4-pentenoate FL/FR |
ethyl aconitate FL |
farnesyl acetone FL/FR |
geranyl acetoacetate FL/FR |
geranyl ethyl ether FL/FR |
2- heptenoic acid FL |
2- hexanol FL/FR |
2- hexenal FL |
2- hexenal diethyl acetal FL |
hexyl (E)-2-hexenoate FL |
methyl (E)-2-hexenoate FL/FR |
2- methyl butyl isobutyrate FL |
2- methyl butyl propionate FL |
methyl hydrocinnamate FL/FR |
S-( methyl thio) hexanoate FL |
(E)-2- methyl-2-octenal FL |
2- methyl-2-octenal FL |
3- methyl-3-pentanol FL |
nonan-3-yl acetate FL/FR |
(E,E)-3,5- octadien-2-one FL |
oenanthic ether FL |
phenethyl senecioate FL/FR |
prenyl ethyl ether FL/FR |
prenyl hexanoate FL/FR |
propyl valerate FL/FR |
propylene acetal FL/FR |
sorbyl propionate FL |
viridiflorol FL/FR |
alliaceous |
alliaceous |
tropical thiazole FL/FR |
burnt |
2- methoxypyridine FL |
chemical |
methyl ethyl ketone FL/FR |
citrus |
cognac heptanone FL/FR |
cooling |
manzanate (Givaudan) FL/FR |
estery |
ethyl acetoacetate FL/FR |
ethereal |
butyl acetate FL/FR |
iso butyl alcohol FL/FR |
ethyl acetate FL/FR |
ethyl formate FL/FR |
methyl acetate FL/FR |
methyl isobutyrate FL/FR |
2- methyl-1-butanol FL/FR |
iso propyl acetate FL/FR |
fatty |
iso amyl laurate FL/FR |
methyl decanoate FL/FR |
fruity |
amyl acetate FL/FR |
iso amyl acetoacetate FL/FR |
iso amyl benzoate FL/FR |
amyl formate FL/FR |
amyl heptanoate FL/FR |
iso amyl octanoate FL/FR |
benzyl methyl ether FL/FR |
iso butyl acetate FL/FR |
iso butyl acetoacetate FL/FR |
butyl anthranilate FL/FR |
butyl hexanoate FL/FR |
butyl isobutyrate FL/FR |
iso butyl propionate FL/FR |
iso butyl valerate FL/FR |
cherry pentenoate FL/FR |
diethyl malonate FL/FR |
diethyl sebacate FL/FR |
dimethyl anthranilate FL/FR |
dimethyl succinate FL/FR |
ethyl (E)-2-octenoate FL |
ethyl 2-octenoate FL/FR |
2- ethyl butyl acetate FL/FR |
ethyl heptanoate FL/FR |
ethyl propionate FL/FR |
furfuryl propionate FL |
fusel oil FL/FR |
2- heptanol FL/FR |
2- hexen-1-ol FL/FR |
(E)-3- hexen-1-yl acetate FL/FR |
(Z)-3- hexen-1-yl isobutyrate FL/FR |
hexyl acetate FL/FR |
hexyl phenyl acetate FL/FR |
methyl (E)-3-nonenoate FL |
methyl 2-methyl butyrate FL/FR |
methyl 3-nonenoate FL/FR |
2- methyl allyl butyrate FL |
2- methyl butyl 2-methyl butyrate FL/FR |
methyl heptanoate FL/FR |
methyl hexanoate FL/FR |
octen-1-yl cyclopentanone FL/FR |
2- pentanone FL/FR |
pineapple pentenoate FL/FR |
prenol FL/FR |
iso propyl 2-methyl butyrate FL/FR |
iso propyl butyrate FL/FR |
propyl formate FL/FR |
propyl isobutyrate FL/FR |
iso propyl propionate FL/FR |
sorbyl butyrate FL/FR |
terpinyl cinnamate FL/FR |
tetrahydrofurfuryl butyrate FL/FR |
tiglaldehyde FL/FR |
iso valeraldehyde propylene glycol acetal FL/FR |
fusel |
white cognac oil FL/FR |
green cognac oil FL/FR |
methyl butyrate FL/FR |
green |
acetaldehyde dihexyl acetal FL/FR |
allyl butyrate FL/FR |
iso amyl formate FL/FR |
iso amyl isovalerate FL/FR |
benzaldehyde dimethyl acetal FL/FR |
cassis pentanone FL/FR |
cyclohexyl formate FL/FR |
ethyl (E,Z)-2,4-decadienoate FL/FR |
2- ethyl butyraldehyde FL |
heptanal dimethyl acetal FL/FR |
hexanol FL/FR |
(Z)-3- hexen-1-yl butyrate FL/FR |
(E)-2- hexen-1-yl hexanoate FL/FR |
(Z)-3- hexen-1-yl hexanoate FL/FR |
1- hexen-3-ol FL/FR |
(E)-2- hexenal diethyl acetal FL |
hexyl (E)-tiglate FL/FR |
hexyl isobutyrate FL/FR |
hexyl octanoate FL/FR |
methyl 2-undecynoate FL |
(Z)-2- penten-1-ol FL/FR |
2- pentyl furan FL/FR |
phenoxyethyl isobutyrate FL/FR |
honey |
phenethyl acetate FL/FR |
jammy |
maltyl isobutyrate FL/FR |
musty |
2- pentanol FL/FR |
propionaldehyde FL |
nutty |
acetal FL/FR |
pungent |
acetaldehyde FL |
rummy |
iso butyl formate FL/FR |
ethyl pyruvate FL/FR |
(E)-2- hexen-1-yl formate FL/FR |
sulfurous |
buchu mercaptan FL/FR |
methyl 2-(methyl thio) butyrate FL |
methyl thiomethyl butyrate FL |
tropical |
beta- cyclocitral FL/FR |
passiflora acetate FL/FR |
vegetable |
2- methyl valeraldehyde FL/FR |
waxy |
allyl nonanoate FL/FR |
iso amyl butyrate FL/FR |
butyl undecylenate FL/FR |
ethyl nonanoate FL/FR |
ethyl octanoate FL/FR |
octyl 2-methyl butyrate FL/FR |
octyl butyrate FL/FR |
propyl heptanoate FL/FR |
whiskey |
3- methyl-1-pentanol FL/FR |
winey |
methyl nonanoate FL/FR |
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| acetaldehyde di-iso amyl acetal | | acetaldehyde di-isoamyl acetal | | acetaldehyde di(3-methyl butyl) acetal | | acetaldehyde di(3-methylbutyl) acetal | | butane, 1,1'-[ethylidenebis(oxy)]bis[3-methyl- | 1,1- | di-isopentyloxyethane | 1,1- | di(3-methylbutoxy)ethane | 1,1- | diisopentyloxyethane | 1,1'-( | ethylidene bis(oxy)) bis(3-methyl butane) | 1,1'-( | ethylidenebis(oxy))bis(3-methylbutane) | 1,1'-[ | ethylidenebis(oxy)]bis(3-methylbutane) | 3- | methyl-1-(1-(3-methyl butoxy)ethoxy) butane | 3- | methyl-1-[1-(3-methyl-butoxy)-ethoxy]-butane | 3- | methyl-1-[1-(3-methylbutoxy)ethoxy]butane | 1,1-bis(iso | pentyloxy)ethane |
Articles:
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