| SpectraBase Compound ID | JOLtUH51Hu4 |
|---|---|
| InChI | InChI=1S/C29H49NO2/c1-18-6-11-27(30(17-18)20(3)31)19(2)24-9-10-25-23-8-7-21-16-22(32)12-14-28(21,4)26(23)13-15-29(24,25)5/h18-19,21-27,32H,6-17H2,1-5H3/t18-,19?,21+,22+,23?,24?,25?,26?,27?,28?,29?/m1/s1 |
| InChIKey | MYLVWCOQZOREBJ-NOVYFODZSA-N |
| Mol Weight | 443.7 g/mol |
| Molecular Formula | C29H49NO2 |
| Exact Mass | 443.37633 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CQnHSpa45Qd |
|---|---|
| Name | 22,26-Acetyl=epimino-5.alpha.-cholestan-3.beta.-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H49NO2 |
| InChI | InChI=1S/C29H49NO2/c1-18-6-11-27(30(17-18)20(3)31)19(2)24-9-10-25-23-8-7-21-16-22(32)12-14-28(21,4)26(23)13-15-29(24,25)5/h18-19,21-27,32H,6-17H2,1-5H3/t18-,19?,21+,22+,23?,24?,25?,26?,27?,28?,29?/m1/s1 |
| InChIKey | MYLVWCOQZOREBJ-NOVYFODZSA-N |
| Molecular Weight | 443.716 g/mol |
| SMILES | O[C@]1(CCC2(C3CCC4(C(C(C5N(C(=O)C)C[C@@](CC5)(C)[H])C)CCC4C3CC[C@]2(C1)[H])C)C)[H] |
| SPLASH | splash10-0006-3900000000-17cfc84f80165e664e16 |
| Source of Spectrum | X2-50-645-4 |
| Wiley ID | 1602286 |