| SpectraBase Compound ID | JFge4PD9q2a |
|---|---|
| InChI | InChI=1S/C25H40O2/c1-5-6-8-17(2)21-12-13-22-20(9-7-14-25(21,22)4)11-10-19-15-23(26)18(3)24(27)16-19/h10-11,17,21-24,26-27H,3,5-9,12-16H2,1-2,4H3/b20-11+/t17-,21+,22-,23+,24+,25+/m0/s1 |
| InChIKey | PPXATBHVDXKJAT-QOFIXJPPSA-N |
| Mol Weight | 372.6 g/mol |
| Molecular Formula | C25H40O2 |
| Exact Mass | 372.302831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CC8VmkRnE7b |
|---|---|
| Name | (20S)-2-methylene-19,26,27-trinor-1.alpha.-hydroxycalciferol |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H40O2 |
| InChI | InChI=1S/C25H40O2/c1-5-6-8-17(2)21-12-13-22-20(9-7-14-25(21,22)4)11-10-19-15-23(26)18(3)24(27)16-19/h10-11,17,21-24,26-27H,3,5-9,12-16H2,1-2,4H3/b20-11+/t17-,21+,22-,23+,24+,25+/m0/s1 |
| InChIKey | PPXATBHVDXKJAT-QOFIXJPPSA-N |
| Ionization Type | EI |
| Molecular Weight | 372.593 g/mol |
| SMILES | O[C@@]1(CC(C[C@](C1=C)(O)[H])=C\C=C/1CCC[C@]2([C@]1(CC[C@@]2([C@](CCCC)(C)[H])[H])[H])C)[H] |
| SPLASH | splash10-00ri-0965000000-6d513fbc96b391d06f25 |
| Source of Spectrum | EP1828113B1 |
| Wiley ID | 1841730 |