| SpectraBase Compound ID | 7qkMSvhEmEs |
|---|---|
| InChI | InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19-,20+,22-,23-,24?,25-,26-,27-,28+/m0/s1 |
| InChIKey | OILXMJHPFNGGTO-GDCSECBDSA-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 | Cz84wt1RhJa |
|---|---|
| Name | 3.beta.-Hydroxy-24(R)-methylcholest-5-ene |
| Alternate Name(s) | (3beta,22E)-ergosta-5,22-dien-3-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H46O |
| InChI | InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19-,20+,22-,23-,24?,25-,26-,27-,28+/m0/s1 |
| InChIKey | OILXMJHPFNGGTO-GDCSECBDSA-N |
| Molecular Weight | 398.675 g/mol |
| SMILES | O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CCC4[C@@](\C=C\[C@@](C(C)C)(C)[H])(C)[H])[H])C)[H])C)[H] |
| SPLASH | splash10-001j-0009000000-5b1b444b710553e74500 |
| Source of Spectrum | X4-28-76-0 |
| Wiley ID | 1586442 |