SpectraBase Compound ID | BfAUEgpTvCZ |
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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 |
SpectraBase Spectrum ID | 8FH3gj7CU0L |
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Name | Thiocholesterol |
Source of Sample | Aldrich |
Catalog Number | 136115 |
CAS Registry Number | 1249-81-6 |
Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 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 |
Synonyms | 5-Cholestene-3beta-thiol Cholesteryl mercaptan |
Wiley ID | SIAL_ATR-IR_007947 |