| SpectraBase Compound ID | 4LQKglIpALp |
|---|---|
| InChI | InChI=1S/C27H45IO/c1-18(2)6-5-7-19(3)23-10-11-24-22-9-8-20-16-21(29)12-15-27(20,17-28)25(22)13-14-26(23,24)4/h8,18-19,21-25,29H,5-7,9-17H2,1-4H3/t19-,21+,22+,23-,24+,25+,26-,27-/m1/s1 |
| InChIKey | FIOAEFCJGZJUPW-FTLVODPJSA-N |
| Mol Weight | 512.6 g/mol |
| Molecular Formula | C27H45IO |
| Exact Mass | 512.251511 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Eew476Lzn8 |
|---|---|
| Name | 19-IODOCHOLEST-5-EN-3-BETA-OL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H45IO |
| InChI | InChI=1S/C27H45IO/c1-18(2)6-5-7-19(3)23-10-11-24-22-9-8-20-16-21(29)12-15-27(20,17-28)25(22)13-14-26(23,24)4/h8,18-19,21-25,29H,5-7,9-17H2,1-4H3/t19-,21+,22+,23-,24+,25+,26-,27-/m1/s1 |
| InChIKey | FIOAEFCJGZJUPW-FTLVODPJSA-N |
| Literature Reference Author | K.N.SCOTT,T.H.MARECI |
| Literature Reference Citation | CAN.J.CHEM.,57,27(1979) |
| Literature Reference DOI | 10.1139/v79-005 |
| Molecular Weight | 512.558 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED973 |