| SpectraBase Compound ID | AfTcvDhAR6r |
|---|---|
| InChI | InChI=1S/C25H36O6/c1-14(26)30-13-22(29)20-8-7-19-18-6-5-16-11-17(31-15(2)27)9-10-24(16,3)23(18)21(28)12-25(19,20)4/h16-20,23H,5-13H2,1-4H3/t16-,17-,18+,19+,20-,23-,24+,25+/m1/s1 |
| InChIKey | KXMNKLIYGUTTRM-ZOVZTONPSA-N |
| Mol Weight | 432.6 g/mol |
| Molecular Formula | C25H36O6 |
| Exact Mass | 432.251189 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | 58w0tjJ57s5 |
|---|---|
| Name | 5β-pregnan-3α,21-diol-11,20-dione diacetate |
| Source of Sample | Steraloids Inc. |
| Catalog Number | P6250-000 |
| Lot Number | 1686 |
| Accessory | DurasamplIR II |
| Compound Type | Pure |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H36O6 |
| InChI | InChI=1S/C25H36O6/c1-14(26)30-13-22(29)20-8-7-19-18-6-5-16-11-17(31-15(2)27)9-10-24(16,3)23(18)21(28)12-25(19,20)4/h16-20,23H,5-13H2,1-4H3/t16-,17-,18+,19+,20-,23-,24+,25+/m1/s1 |
| InChIKey | KXMNKLIYGUTTRM-ZOVZTONPSA-N |
| Instrument Name | Bio-Rad FTS |
| Source of Spectrum | Forensic Spectral Research |
| Technique | ATR-Neat (DuraSamplIR II) |