| SpectraBase Compound ID | 9z2sgz1xIbi |
|---|---|
| InChI | InChI=1S/C26H45NO/c1-17(2)7-6-8-18(3)20-10-11-21-19-9-12-23-26(5,16-14-24(28)27-23)22(19)13-15-25(20,21)4/h17-23H,6-16H2,1-5H3,(H,27,28)/t18-,19+,20-,21+,22+,23+,25+,26-/m1/s1 |
| InChIKey | WJSKTFAFISQDLB-QKPVXUJESA-N |
| Mol Weight | 387.7 g/mol |
| Molecular Formula | C26H45NO |
| Exact Mass | 387.350115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ly5KGUFWVHT |
|---|---|
| Name | 4-AZA-5-BETA-CHOLESTAN-3-ONE |
| Compound Number | 22 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H45NO |
| InChI | InChI=1S/C26H45NO/c1-17(2)7-6-8-18(3)20-10-11-21-19-9-12-23-26(5,16-14-24(28)27-23)22(19)13-15-25(20,21)4/h17-23H,6-16H2,1-5H3,(H,27,28)/t18-,19+,20-,21+,22+,23+,25+,26-/m1/s1 |
| InChIKey | WJSKTFAFISQDLB-QKPVXUJESA-N |
| Literature Reference Author | O.E.EDWARDS,G.GRUE-SORENSEN,B.A.BLACKWELL |
| Literature Reference Citation | CAN.J.CHEM.,75,857(1997) |
| Literature Reference DOI | 10.1139/v97-104 |
| Molecular Weight | 387.649 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP6488 |