| SpectraBase Compound ID | FPIMtMClSsT |
|---|---|
| InChI | InChI=1S/C15H21F3O5/c1-9(19)23-12-5-4-11(20)10-8-13(21-2,22-3)6-7-14(10,12)15(16,17)18/h10,12H,4-8H2,1-3H3/t10-,12-,14+/m0/s1 |
| InChIKey | KWCUMWPBJORQDO-VHRBIJSZSA-N |
| Mol Weight | 338.32 g/mol |
| Molecular Formula | C15H21F3O5 |
| Exact Mass | 338.134108 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ClOQ47wCmqI |
|---|---|
| Name | 4.beta.-acetoxy-3,4,4a.beta.,5,6,8a.beta.-hexahydro-4a-trifluoromethylnaphthalene-1,7(2H,8H)-dione-7,7-dimethyl -ketal |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H21F3O5 |
| InChI | InChI=1S/C15H21F3O5/c1-9(19)23-12-5-4-11(20)10-8-13(21-2,22-3)6-7-14(10,12)15(16,17)18/h10,12H,4-8H2,1-3H3/t10-,12-,14+/m0/s1 |
| InChIKey | KWCUMWPBJORQDO-VHRBIJSZSA-N |
| Molecular Weight | 338.323 g/mol |
| SMILES | [C@]12([C@](C(=O)CC[C@@]2(OC(=O)C)[H])(CC(CC1)(OC)OC)[H])C(F)(F)F |
| SPLASH | splash10-0udi-0901000000-9cf5028ae7bd166c3afe |
| Source of Spectrum | KC-1991-1123-7 |
| Synonyms | (1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)decahydro-1-naphthalenyl acetate acetic acid[(1S,4aR,8aR)-4-keto-6,6-dimethoxy-8a-(trifluoromethyl)decalin-1-yl]ester acetic acid[(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl]ester [(1S,4aR,8aR)-6,6-dimethoxy-4-oxidanylidene-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl]ethanoate [(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl]acetate [(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)decalin-1-yl]acetate acetic acid [(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl] ester [(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl] acetate [(1S,4aR,8aR)-6,6-dimethoxy-4-oxo-8a-(trifluoromethyl)decalin-1-yl] acetate [(1S,4aR,8aR)-6,6-dimethoxy-4-oxidanylidene-8a-(trifluoromethyl)-2,3,4a,5,7,8-hexahydro-1H-naphthalen-1-yl] ethanoate |
| Wiley ID | 1333466 |