| SpectraBase Compound ID | IYjBnqQwsSy |
|---|---|
| InChI | InChI=1S/C27H46O/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/h18-20,22-25H,6-17H2,1-5H3/t19-,20-,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | PESKGJQREUXSRR-JDIFZLMISA-N |
| Mol Weight | 386.7 g/mol |
| Molecular Formula | C27H46O |
| Exact Mass | 386.354866 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | GCisRT91jNJ |
|---|---|
| Name | 5β-Cholestan-3-one |
| Source of Sample | Steraloids Inc. |
| Catalog Number | C5250-000 |
| Lot Number | L1812 |
| CAS Registry Number | 601-53-6 |
| Classification | cholesterol type |
| Compound Type | Pure |
| Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H46O |
| InChI | InChI=1S/C27H46O/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/h18-20,22-25H,6-17H2,1-5H3/t19-,20-,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | PESKGJQREUXSRR-JDIFZLMISA-N |
| Melting Point | 61.0 - 62.0 °C |
| Molecular Weight | 386.664 g/mol |
| Raman Corrections | Referenced to internal white light source; 180 Degree backscatter |
| Raman Laser Source | Nd:YAG |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | Coprostanone; 3-Oxocholestanone |
| Technique | FT-Raman |