| SpectraBase Spectrum ID |
8LDeubyIpIb |
| Name |
17-Oxoandrostan-3-yl trifluoroacetate |
| Alternate Name(s) |
5.beta.-Androstan-3.alpha.-ol-17-one 3-O-trifluoroacetyl- |
| CAS Registry Number |
2193-54-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29F3O3 |
| InChI |
InChI=1S/C21H29F3O3/c1-19-9-7-13(27-18(26)21(22,23)24)11-12(19)3-4-14-15-5-6-17(25)20(15,2)10-8-16(14)19/h12-16H,3-11H2,1-2H3/t12?,13-,14+,15+,16+,19+,20+/m1/s1 |
| InChIKey |
NTPCFTHVUCOBOX-XJOQJFINSA-N |
| Molecular Weight |
386.455 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CCC2C[C@](OC(C(F)(F)F)=O)(CC1)[H])[H])C |
| SPLASH |
splash10-000l-9627000000-744d618b63a102c8913c |
| Source of Spectrum |
PG-1982-259-0 |
| Wiley ID |
1362640 |
