| 2D Structure | |
| CID | 12613 |
| Target | / |
| IUPAC Name | 3-methylbutyl 3-methylbutanoate |
| InChI | InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3 |
| InChI Key | XINCECQTMHSORG-UHFFFAOYSA-N |
| Canonical SMILES | CC(C)CCOC(=O)CC(C)C |
| Isomeric SMILES | CC(C)CCOC(=O)CC(C)C |
| Molecular Formula | C10H20O2 |
| Molecular Weight | 172.26 |
| synonyms | ['ISOAMYL ISOVALERATE', '659-70-1', 'Isopentyl 3-methylbutanoate', '3-Methylbutyl 3-methylbutanoate', 'Isopentyl isopentanoate', 'Solusterol', 'iso-Amyl isovalerate', 'Isopentyl isovalerate', 'Isoamyl valerianate', 'Apple essence', '3-Methylbutyl isovalerate', 'Butanoic acid, 3-methyl-, 3-methylbutyl ester', 'Isovaleric acid, isopentyl ester', 'Isoamyl 3-methylbutanoate', 'Isopentyl 3-methylbutyrate', 'Isoamyl 3-methylbutyrate', 'Isoamyl isopentanoate', 'Isoamyl isovalerianate', '3-Methylbutyl 3-methylbutyrate', 'Isopentyl alcohol, isovalerate', 'FEMA No. 2085', 'NSC 6565', 'Isoamyl isovalerate (natural)', 'CCRIS 1348', 'EINECS 211-536-1', '16M1VA1FJY', 'BRN 1753884', 'DTXSID8044757', 'AI3-06045', 'NSC-6565', 'DTXCID6024757', 'ISOAMYL ISOVALERATE [MI]', 'XINCECQTMHSORG-UHFFFAOYSA-', 'ISOAMYL ISOVALERATE [FCC]', 'ISOAMYL ISOVALERATE [FHFI]', '211-536-1', 'inchi=1/c10h20o2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9h,5-7h2,1-4h3', 'Isovaleric Acid Isoamyl Ester', '3-methylbutanoic acid 3-methylbutyl ester', 'CHEBI:31727', 'UNII-16M1VA1FJY', 'isoamyl_isovalerate', 'MFCD00048369', 'iso-amyl iso-valerate', 'Isopentyl 3-methylbutanoate #', 'SCHEMBL113763', 'Isovaleric Acid Isopentyl Ester', 'CHEMBL3189076', 'FEMA 2085', 'NSC6565', 'Tox21_301620', 'WLN: 1Y1&2OV1Y1&1', 'LMFA07010919', 'AKOS015907822', '(3-methyl-1-butyl) 3-methylbutanoate', 'Isoamyl isovalerate, >=98%, FCC, FG', 'NCGC00256163-01', 'AS-59218', 'CAS-659-70-1', '3-methyl-butyric acid 3-methyl-butyl ester', 'I0196', 'NS00012660', 'D97798', 'Isoamyl isovalerate, natural, >=98%, FCC, FG', 'A835290', 'Q11066025'] |
From Pubchem