| SpectraBase Compound ID | 4kajOF2t5dy |
|---|---|
| InChI | InChI=1S/C30H44N2O2/c1-18(8-13-28-31-25-6-4-5-7-26(25)32-28)22-11-12-23-21-10-9-19-16-20(33)14-15-29(19,2)24(21)17-27(34)30(22,23)3/h4-7,18-24,27,33-34H,8-17H2,1-3H3,(H,31,32)/t18?,19?,20-,21?,22?,23?,24?,27+,29?,30?/m1/s1 |
| InChIKey | CPQPGCCXHDVMFE-KOTQIMMJSA-N |
| Mol Weight | 464.7 g/mol |
| Molecular Formula | C30H44N2O2 |
| Exact Mass | 464.340279 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KI5rYnxunW8 |
|---|---|
| Name | 23-(Benzimidazol-2'-yl)nor-cholan-3.alpha.,12.alpha.-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H44N2O2 |
| InChI | InChI=1S/C30H44N2O2/c1-18(8-13-28-31-25-6-4-5-7-26(25)32-28)22-11-12-23-21-10-9-19-16-20(33)14-15-29(19,2)24(21)17-27(34)30(22,23)3/h4-7,18-24,27,33-34H,8-17H2,1-3H3,(H,31,32)/t18?,19?,20-,21?,22?,23?,24?,27+,29?,30?/m1/s1 |
| InChIKey | CPQPGCCXHDVMFE-KOTQIMMJSA-N |
| Molecular Weight | 464.694 g/mol |
| SMILES | O[C@]1(CC2C(C3C(C4C(C(C(CCc5nc6ccccc6[nH]5)C)CC4)([C@](C3)(O)[H])C)CC2)(CC1)C)[H] |
| SPLASH | splash10-000t-2900000000-2f014ce1dd1934713a6f |
| Source of Spectrum | G-60-264-0 |
| Wiley ID | 748940 |