1.0
2010-04-08 22:14:44 UTC
2015-07-21 06:41:37 UTC
FDB020008
1-Phenylethyl propanoate
Flavouring agent
α-methylbenzyl propionate
1-Phenyl-1-ethyl propionate
1-Phenylethyl propanoate
1-Phenylethyl propionate
Alpha-methylbenzenemethanol propanoate
Alpha-methylbenzyl alcohol, propionate
Alpha-methylbenzyl propanoate
Alpha-methylbenzyl propionate
Benzenemethanol, α-methyl-, propanoate
Benzenemethanol, alpha-methyl-, 1-propanoate
Benzenemethanol, alpha-methyl-, propanoate
Benzyl alcohol, α-methyl-, propionate
Benzyl alcohol, alpha-methyl-, propionate
FEMA 2689
Methylphenylcarbinyl propionate
Phenylmethylcarbinyl propionate
Propionic acid, alpha-methylbenzyl ester
Styrallyl propionate
Styralyl propionate
Styrolyl propionate
C11H14O2
178.2277
178.099379692
120-45-6
CCC(=O)OC(C)C1=CC=CC=C1
InChI=1S/C11H14O2/c1-3-11(12)13-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
WCIQNYOXLZQQMU-UHFFFAOYSA-N
belongs to the class of organic compounds known as benzyloxycarbonyls. These are organic compounds containing a carbonyl group substituted with a benzyloxyl group.
Benzyloxycarbonyls
Organic compounds
Benzenoids
Benzene and substituted derivatives
Benzyloxycarbonyls
Aromatic homomonocyclic compounds
Carbonyl compounds
Carboxylic acid esters
Hydrocarbon derivatives
Monocarboxylic acids and derivatives
Organic oxides
Aromatic homomonocyclic compound
Benzyloxycarbonyl
Carbonyl group
Carboxylic acid derivative
Carboxylic acid ester
Hydrocarbon derivative
Monocarboxylic acid or derivatives
Organic oxide
Organic oxygen compound
Organooxygen compound
average_mass
178.2277
mono_mass
178.099379692
smiles
CCC(=O)OC(C)C1=CC=CC=C1
formula
C11H14O2
inchi
InChI=1S/C11H14O2/c1-3-11(12)13-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
inchikey
WCIQNYOXLZQQMU-UHFFFAOYSA-N
Specdb::CMs
23215
Specdb::CMs
28521
Specdb::CMs
102115
Specdb::CMs
167945
Specdb::MsIr
8889
Specdb::MsIr
8890
Specdb::MsMs
96318
Specdb::MsMs
96319
Specdb::MsMs
96320
Specdb::MsMs
160770
Specdb::MsMs
160771
Specdb::MsMs
160772
Specdb::MsMs
2779741
Specdb::MsMs
2779742
Specdb::MsMs
2779743
Specdb::MsMs
2903112
Specdb::MsMs
2903113
Specdb::MsMs
2903114
HMDB40287
#<Reference:0x0000555672f7c510>
floral
fresh
gardenia
green
rose
sweet
weedy