| SpectraBase Compound ID | 7mUjs28IBCJ |
|---|---|
| InChI | InChI=1S/C27H48O2/c1-17(2)9-8-10-18(3)19-12-13-20-23-21(14-16-27(19,20)5)26(4)15-7-6-11-22(26)24(28)25(23)29/h17-25,28-29H,6-16H2,1-5H3/t18-,19-,20+,21+,22-,23+,24+,25+,26-,27-/m1/s1 |
| InChIKey | VMUIFEIFBPLOQQ-WBFAAJKYSA-N |
| Mol Weight | 404.7 g/mol |
| Molecular Formula | C27H48O2 |
| Exact Mass | 404.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | UHXQaY36Il |
|---|---|
| Name | 5-ALPHA-CHOLESTAN-6-BETA,7-ALPHA-DIOL |
| CAS Registry Number | 20834-91-7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H48O2 |
| InChI | InChI=1S/C27H48O2/c1-17(2)9-8-10-18(3)19-12-13-20-23-21(14-16-27(19,20)5)26(4)15-7-6-11-22(26)24(28)25(23)29/h17-25,28-29H,6-16H2,1-5H3/t18-,19-,20+,21+,22-,23+,24+,25+,26-,27-/m1/s1 |
| InChIKey | VMUIFEIFBPLOQQ-WBFAAJKYSA-N |
| Literature Reference Author | C.L.VANANTWERP,H.EGGERT,G.D.MEAKINS,J.O.MINERS,C.DJERASSI |
| Literature Reference Citation | J.ORG.CHEM.,42,789(1977) |
| Literature Reference DOI | 10.1021/jo00425a005 |
| Molecular Weight | 404.677 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW9700 |