| SpectraBase Compound ID | LSyAYbd9w8w |
|---|---|
| InChI | InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h17-25,28-29H,6-16H2,1-5H3/t18-,19+,20-,21+,22-,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | QKKCBCJYKCUZIS-INFCVREISA-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 | J9cRliUo47L |
|---|---|
| Name | 5-ALPHA-CHOLESTAN-1-ALPHA,3-BETA-DIOL |
| CAS Registry Number | 571-00-6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H48O2 |
| InChI | InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(28)16-25(29)27(19,5)24(21)13-14-26(22,23)4/h17-25,28-29H,6-16H2,1-5H3/t18-,19+,20-,21+,22-,23+,24+,25+,26-,27+/m1/s1 |
| InChIKey | QKKCBCJYKCUZIS-INFCVREISA-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 | UNIW9690 |