| SpectraBase Spectrum ID |
6CCNaaRwaoT |
| Name |
Androstan-17-ol, heptafluorobutanoate, (5.alpha.,17.beta.)- |
| CAS Registry Number |
60881-90-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H31F7O2 |
| InChI |
InChI=1S/C23H31F7O2/c1-19-11-4-3-5-13(19)6-7-14-15-8-9-17(20(15,2)12-10-16(14)19)32-18(31)21(24,25)22(26,27)23(28,29)30/h13-17H,3-12H2,1-2H3/t13-,14+,15+,16+,17+,19+,20+/m1/s1 |
| InChIKey |
ABOSMRZXOLQJJG-QVSCJOEQSA-N |
| Molecular Weight |
472.488 g/mol |
| SMILES |
C(C(C(O[C@@]1([C@@]2([C@@]([C@@]3(CC[C@@]4([C@]([C@]3(CC2)[H])(C)CCCC4)[H])[H])([H])CC1)C)[H])=O)(F)F)(C(F)(F)F)(F)F |
| SPLASH |
splash10-0apj-7290600000-bee2262e4b2f5ff15564 |
| Source of Spectrum |
AN-85-342-0 |
| Synonyms |
(5alpha,17beta)-androstan-17-yl 2,2,3,3,4,4,4-heptafluorobutanoate
17.beta.-heptafluorobutanoyloxy (5.alpha.)androstane |
| Wiley ID |
1393278 |
