| SpectraBase Compound ID | FveEE3Zp2Bo |
|---|---|
| InChI | InChI=1S/C22H36O2/c1-14(2)18-9-10-19-17(6-5-11-22(18,19)4)8-7-16-12-20(23)15(3)21(24)13-16/h7-8,14-15,18-21,23-24H,5-6,9-13H2,1-4H3/b16-7-,17-8+/t15-,18+,19-,20+,21+,22+/m0/s1 |
| InChIKey | DULANFWARZICAI-XXRMSDPUSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C22H36O2 |
| Exact Mass | 332.27153 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5lYx2NpVAFq |
|---|---|
| Name | 2.alpha.-Methyl-19-nor-(20S)-1.alpha.-hydroxy-homopregnacalciferol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H36O2 |
| InChI | InChI=1S/C22H36O2/c1-14(2)18-9-10-19-17(6-5-11-22(18,19)4)8-7-16-12-20(23)15(3)21(24)13-16/h7-8,14-15,18-21,23-24H,5-6,9-13H2,1-4H3/b16-7-,17-8+/t15-,18+,19-,20+,21+,22+/m0/s1 |
| InChIKey | DULANFWARZICAI-XXRMSDPUSA-N |
| Ionization Type | EI |
| Molecular Weight | 332.528 g/mol |
| SMILES | O[C@@]1(C\C(C[C@]([C@]1(C)[H])(O)[H])=C\C=C\1[C@]2([C@](CCC1)([C@](CC2)(C(C)C)[H])C)[H])[H] |
| SPLASH | splash10-003l-4936000000-a2d1f55a15f008c15cf2 |
| Source of Spectrum | US8188064B2 |
| Wiley ID | 1845255 |