| 2D Structure | |
| CID | 7658 |
| Target | LOC116160065 |
| IUPAC Name | 2-phenylethyl butanoate |
| InChI | InChI=1S/C12H16O2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3 |
| InChI Key | WFNDDSQUKATKNX-UHFFFAOYSA-N |
| Canonical SMILES | CCCC(=O)OCCC1=CC=CC=C1 |
| Isomeric SMILES | CCCC(=O)OCCC1=CC=CC=C1 |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.25 |
| synonyms | ['Phenethyl butyrate', '103-52-6', '2-Phenylethyl butanoate', 'Phenylethyl butyrate', 'Butanoic acid, 2-phenylethyl ester', '2-Phenethyl butanoate', 'Benzylcarbinyl butyrate', 'Phenethyl butanoate', '2-Phenylethyl butyrate', 'BUTYRIC ACID, PHENETHYL ESTER', 'beta-Phenethyl n-butanoate', 'FEMA No. 2861', 'Phenethyl butyrate (natural)', 'beta-Phenylethyl butyrate', 'NSC 1271', '.beta.-Phenylethyl butyrate', 'EINECS 203-119-8', 'UNII-02E08ZN98R', 'BRN 1955788', 'DTXSID6047604', 'CHEBI:87413', 'AI3-02954', 'butanoic acid 2-phenylethyl ester', '02E08ZN98R', 'NSC-1271', 'NSC-406207', '.beta.-Phenethyl n-butanoate', '.beta.-Phenylethyl n-butyrate', 'DTXCID4027604', 'PHENETHYL BUTYRATE [FHFI]', 'PHENYLETHYL BUTYRATE [FCC]', 'beta-Phenylethyl n-butyrate', '203-119-8', '4-06-00-03073 (beilstein handbook reference)', 'inchi=1/c12h16o2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h3-5,7-8h,2,6,9-10h2,1h', 'wfnddsqukatknx-uhfffaoysa-n', 'beta -phenylethyl butyrate', 'beta -phenethyl N-butanoate', 'beta -phenylethyl N-butyrate', 'SCHEMBL585144', 'CHEMBL3187974', 'FEMA 2861', 'NSC1271', 'AAA10352', 'Tox21_302607', 'NSC406207', 'AKOS015964870', 'Phenethyl butyrate, >=98%, FCC, FG', 'NCGC00256919-01', 'AS-57067', 'CAS-103-52-6', 'DB-040460', 'NS00013111', 'E79212', 'Q10864412'] |
From Pubchem