| SpectraBase Spectrum ID |
9eR3w6ZnD9p |
| Name |
3-.beta.-Acetylxyepiandrost-16-en-17-yl trifluoromethanesulphonate |
| Alternate Name(s) |
(3beta)-17-{[(trifluoromethyl)sulfonyl]oxy}androst-16-en-3-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H31F3O5S |
| InChI |
InChI=1S/C22H31F3O5S/c1-13(26)29-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(21(17,3)11-9-18(16)20)30-31(27,28)22(23,24)25/h7,14-18H,4-6,8-12H2,1-3H3/t14?,15-,16-,17-,18-,20-,21-/m0/s1 |
| InChIKey |
MEAKWENNYGZFBM-PKIMPSFCSA-N |
| Molecular Weight |
464.540 g/mol |
| SMILES |
C(S(OC=1[C@@]2([C@@]([C@@]3(CCC4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])([H])CC1)C)(=O)=O)(F)(F)F |
| SPLASH |
splash10-0f79-0039300000-3fcf0ea61fefc1c3d8e3 |
| Source of Spectrum |
F-48-3550-0 |
| Wiley ID |
1391418 |
