SpectraBase Compound ID | 8eVJVSgGCTF |
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InChI | InChI=1S/C21H33FO/c1-13(23)17-6-7-18-16-5-4-14-12-15(22)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19H,4-12H2,1-3H3/t14-,15-,16+,17-,18+,19+,20+,21-/m1/s1 |
InChIKey | QJXBAUPOZIECOH-YZRLXODZSA-N |
Mol Weight | 320.5 g/mol |
Molecular Formula | C21H33FO |
Exact Mass | 320.251544 g/mol |
SpectraBase Spectrum ID | GAqh2wTxIQq |
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Name | 3.alpha.-Fluoro-5.beta.-pregnan-20-one |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H33FO |
InChI | InChI=1S/C21H33FO/c1-13(23)17-6-7-18-16-5-4-14-12-15(22)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19H,4-12H2,1-3H3/t14-,15-,16+,17-,18+,19+,20+,21-/m1/s1 |
InChIKey | QJXBAUPOZIECOH-YZRLXODZSA-N |
Molecular Weight | 320.492 g/mol |
SMILES | [C@@]12([C@]([C@@]3(CC[C@]4([C@@]([C@]3(CC2)[H])(CC[C@@](F)(C4)[H])C)[H])[H])(CC[C@@]1(C(=O)C)[H])[H])C |
SPLASH | splash10-05a6-9223000000-ae280fb4d083b36c1824 |
Source of Spectrum | G-73-1833-18 |
Wiley ID | 1693144 |