| SpectraBase Compound ID | BfAUEgpTvCZ |
|---|---|
| InChI | InChI=1S/C27H46S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | QGVQZRDQPDLHHV-DPAQBDIFSA-N |
| Mol Weight | 402.7 g/mol |
| Molecular Formula | C27H46S |
| Exact Mass | 402.332023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | BquYl9NSnDw |
|---|---|
| Name | Cholest-5-ene-3β-thiol |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Comments | Some carbon atoms are unassigned |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46S |
| InChI | InChI=1S/C27H46S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | QGVQZRDQPDLHHV-DPAQBDIFSA-N |
| Molecular Weight | 402.73 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | CHOLEST-5-ENE-3B-THIOL |