| SpectraBase Compound ID | 33wj59ON276 |
|---|---|
| InChI | InChI=1S/C21H30O2.C2H4O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3;1-2(3)4/h4,6,15-16,18-19,23H,5,7-12H2,1-3H3;1H3,(H,3,4)/t15-,16-,18-,19-,20-,21+;/m0./s1 |
| InChIKey | ITGBJJJIHXAKMI-QGQAXDGOSA-N |
| Mol Weight | 374.52 g/mol |
| Molecular Formula | C23H34O4 |
| Exact Mass | 374.24571 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | 9UMeGqdl3Su |
|---|---|
| Name | 3b-Hydroxy-5,16-pregnadien-20-one Acetate |
| Source of Sample | Sigma-Aldrich |
| Lot Number | S448397 |
| Accessory | DurasamplIR II |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.245709571 u |
| Formula | C23H34O4 |
| InChI | InChI=1S/C21H30O2.C2H4O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3;1-2(3)4/h4,6,15-16,18-19,23H,5,7-12H2,1-3H3;1H3,(H,3,4)/t15-,16-,18-,19-,20-,21+;/m0./s1 |
| InChIKey | ITGBJJJIHXAKMI-QGQAXDGOSA-N |
| Instrument Name | Bio-Rad FTS |
| Molecular Weight | 374.521 g/mol |
| Resolution | 4 |
| SMILES | CC(O)=O.CC(C1=CC[C@]2([C@@]3(CC=C4[C@@](CC[C@](C4)([H])O)(C)[C@]3(CC[C@]12C)[H])[H])[H])=O |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | ATR-Neat |