| SpectraBase Compound ID | 4AGPETxZmzd |
|---|---|
| InChI | InChI=1S/C28H46O/c1-17(2)14-19-15-23(19)18(3)24-8-9-25-22-7-6-20-16-21(29)10-12-27(20,4)26(22)11-13-28(24,25)5/h6,17-19,21-26,29H,7-16H2,1-5H3/t18-,19?,21?,22+,23?,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | MEMPEKZNYBWOLL-QQNZDPPYSA-N |
| Mol Weight | 398.7 g/mol |
| Molecular Formula | C28H46O |
| Exact Mass | 398.354866 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Apmq5XL6MUk |
|---|---|
| Name | 22,23-Methylene-cholestene-3-ol;4th diastereomer |
| Alternate Name(s) | 22,23-Methylene-cholesterol 4th diastereomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H46O |
| InChI | InChI=1S/C28H46O/c1-17(2)14-19-15-23(19)18(3)24-8-9-25-22-7-6-20-16-21(29)10-12-27(20,4)26(22)11-13-28(24,25)5/h6,17-19,21-26,29H,7-16H2,1-5H3/t18-,19?,21?,22+,23?,24-,25+,26+,27+,28-/m1/s1 |
| InChIKey | MEMPEKZNYBWOLL-QQNZDPPYSA-N |
| Molecular Weight | 398.675 g/mol |
| SMILES | OC1CC[C@@]2([C@]3(CC[C@@]4([C@@]([C@@](C5C(CC(C)C)C5)(C)[H])(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C |
| SPLASH | splash10-07w9-9875000000-7783a0428628b76df780 |
| Source of Spectrum | SD-1992-0-0 |
| Wiley ID | 1368768 |