| SpectraBase Compound ID | BTvQ4ecOGAA |
|---|---|
| InChI | InChI=1S/C21H36O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18-,19+,20-,21+/m0/s1 |
| InChIKey | CZHLKVQGWWCQEG-RQTZUPFWSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C21H36O3 |
| Exact Mass | 336.266445 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Aq77AVVxDeV |
|---|---|
| Name | 5β-pregnane-3α,11β,20α-triol |
| Source of Sample | Steraloids Inc. |
| Catalog Number | P9350-000 |
| Lot Number | L341 |
| Classification | progesterone type |
| Copyright | Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36O3 |
| InChI | InChI=1S/C21H36O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18-,19+,20-,21+/m0/s1 |
| InChIKey | CZHLKVQGWWCQEG-RQTZUPFWSA-N |
| Melting Point | 206.0 - 208.0 °C |
| Raman Corrections | Referenced to internal white light source; 180 Degree backscatter |
| Raman Laser Source | Nd:YAG |
| Sadtler IR Number | DW2204 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | FT-Raman |