| SpectraBase Compound ID | 9qDvbvxSSan |
|---|---|
| InChI | InChI=1S/C15H24O4/c1-9(2)11-5-6-14(4)7-12(17)13(19-10(3)16)8-15(11,14)18/h9,11,13,18H,5-8H2,1-4H3/t11-,13+,14-,15+/m1/s1 |
| InChIKey | LFLSQIQALGTYSB-BEAPCOKYSA-N |
| Mol Weight | 268.35 g/mol |
| Molecular Formula | C15H24O4 |
| Exact Mass | 268.167459 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DXWDJ2M3fRe |
|---|---|
| Name | Acetic acid (3R,3aS,5S,7aR)-3a-hydroxy-3-isopropyl-7amethyl-6-oxo-octahydro-inden-5-yl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H24O4 |
| InChI | InChI=1S/C15H24O4/c1-9(2)11-5-6-14(4)7-12(17)13(19-10(3)16)8-15(11,14)18/h9,11,13,18H,5-8H2,1-4H3/t11-,13+,14-,15+/m1/s1 |
| InChIKey | LFLSQIQALGTYSB-BEAPCOKYSA-N |
| Molecular Weight | 268.353 g/mol |
| SMILES | O[C@]12[C@@](CC([C@](C2)(OC(=O)C)[H])=O)(CC[C@@]1(C(C)C)[H])C |
| SPLASH | splash10-0006-9100000000-841cdbcbd7c931fec681 |
| Source of Spectrum | QC-23-1044-10 |
| Synonyms | (3R,3aS,5S,7aR)-3a-hydroxy-3-isopropyl-7a-methyl-6-oxooctahydro-1H-inden-5-yl acetate Acetic acid [(3R,3aS,5S,7aR)-3a-hydroxy-7a-methyl-6-oxo-3-propan-2-yl-1,2,3,4,5,7-hexahydroinden-5-yl] ester [(3R,3aS,5S,7aR)-3a-hydroxy-7a-methyl-6-oxo-3-propan-2-yl-1,2,3,4,5,7-hexahydroinden-5-yl] acetate [(3R,3aS,5S,7aR)-3a-hydroxy-3-isopropyl-7a-methyl-6-oxo-1,2,3,4,5,7-hexahydroinden-5-yl] acetate [(3R,3aS,5S,7aR)-7a-methyl-3a-oxidanyl-6-oxidanylidene-3-propan-2-yl-1,2,3,4,5,7-hexahydroinden-5-yl] ethanoate |
| Wiley ID | 1736903 |