| SpectraBase Compound ID | 99ln5mhkabw |
|---|---|
| InChI | InChI=1S/C20H32O3/c1-13-12-17(23-15(3)22)18-19(4,5)10-7-11-20(18,6)16(13)9-8-14(2)21/h16-18H,1,7-12H2,2-6H3/t16-,17-,18-,20+/m0/s1 |
| InChIKey | FRFVAVFESOXLKW-CGBFIWBNSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C20H32O3 |
| Exact Mass | 320.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | As7kQJxs8ze |
|---|---|
| Name | (+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene-4-(3-oxobutyl)decahydro-1-naphthylnyl acetate |
| Alternate Name(s) | Acetic acid [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylene-4-(3-oxobutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] ester [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylidene-4-(3-oxobutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylene-4-(3-oxobutyl)decalin-1-yl] acetate [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylidene-4-(3-oxidanylidenebutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O3 |
| InChI | InChI=1S/C20H32O3/c1-13-12-17(23-15(3)22)18-19(4,5)10-7-11-20(18,6)16(13)9-8-14(2)21/h16-18H,1,7-12H2,2-6H3/t16-,17-,18-,20+/m0/s1 |
| InChIKey | FRFVAVFESOXLKW-CGBFIWBNSA-N |
| Molecular Weight | 320.473 g/mol |
| SMILES | [C@]12([C@@]([C@@](OC(=O)C)(CC([C@@]2(CCC(=O)C)[H])=C)[H])(C(C)(C)CCC1)[H])C |
| SPLASH | splash10-0w2l-4960000000-bca0fb4f3b6f95f0aedf |
| Source of Spectrum | KC-57-5671-12 |
| Wiley ID | 1624854 |