| SpectraBase Spectrum ID |
9CNCjJLjFwq |
| Name |
4.alpha.-acetoxy-3,4,4a.beta.,5,6,7,8.8a.beta.-octahydro-8a-trifluoromethylnaphthalene-1,6(2H,7H)-dione |
| Alternate Name(s) |
(1S)-4,7-dioxo-4a-(trifluoromethyl)decahydro-1-naphthalenyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15F3O4 |
| InChI |
InChI=1S/C13H15F3O4/c1-7(17)20-10-2-3-11(19)12(13(14,15)16)5-4-8(18)6-9(10)12/h9-10H,2-6H2,1H3/t9?,10-,12?/m0/s1 |
| InChIKey |
ADJYTFXSTHCARB-YZRBJQDESA-N |
| Molecular Weight |
292.254 g/mol |
| SMILES |
C12(C([C@@](OC(=O)C)(CCC2=O)[H])CC(CC1)=O)C(F)(F)F |
| SPLASH |
splash10-0udi-0090000000-82d6c2b4c567f671aae5 |
| Source of Spectrum |
KC-1991-1124-21 |
| Wiley ID |
1295053 |
