| SpectraBase Compound ID | DDKmH7qWGyO |
|---|---|
| InChI | InChI=1S/C21H31F/c1-14(22)17-9-10-18-16-8-7-15-6-4-5-12-20(15,2)19(16)11-13-21(17,18)3/h4,6-7,14,16-19H,5,8-13H2,1-3H3/t14?,16-,17+,18-,19-,20-,21+/m0/s1 |
| InChIKey | LHMNYGHMKCNMNO-CVHNGYJVSA-N |
| Mol Weight | 302.48 g/mol |
| Molecular Formula | C21H31F |
| Exact Mass | 302.240979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1TLvJH4DO6I |
|---|---|
| Name | 20-Fluoropregna-3,5-diene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H31F |
| InChI | InChI=1S/C21H31F/c1-14(22)17-9-10-18-16-8-7-15-6-4-5-12-20(15,2)19(16)11-13-21(17,18)3/h4,6-7,14,16-19H,5,8-13H2,1-3H3/t14?,16-,17+,18-,19-,20-,21+/m0/s1 |
| InChIKey | LHMNYGHMKCNMNO-CVHNGYJVSA-N |
| Molecular Weight | 302.477 g/mol |
| SMILES | C=1CC[C@]2(C(C1)=CC[C@]1([C@@]3(CC[C@](C(C)F)([C@@]3(C)CC[C@]21[H])[H])[H])[H])C |
| SPLASH | splash10-0udi-0359000000-a88b409d49b688893334 |
| Source of Spectrum | MZ-34-4379-4 |
| Wiley ID | 1582784 |