| SpectraBase Compound ID | DEWttttUrpP |
|---|---|
| InChI | InChI=1S/C21H28O5/c1-20-8-7-12(22)9-11(20)3-4-13-14-5-6-15(18(24)19(25)26)21(14,2)10-16(23)17(13)20/h9,13-15,17-18,24H,3-8,10H2,1-2H3,(H,25,26)/t13-,14-,15+,17+,18+,20-,21-/m0/s1 |
| InChIKey | XEXHGGJWBLYHQD-FXQXWWPZSA-N |
| Mol Weight | 360.45 g/mol |
| Molecular Formula | C21H28O5 |
| Exact Mass | 360.193674 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 1tCF6cIXzeh |
|---|---|
| Name | 3,11-Dioxo-20α-hydroxypregn-4-en-21-oic acid |
| Source of Sample | M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28O5 |
| InChI | InChI=1S/C21H28O5/c1-20-8-7-12(22)9-11(20)3-4-13-14-5-6-15(18(24)19(25)26)21(14,2)10-16(23)17(13)20/h9,13-15,17-18,24H,3-8,10H2,1-2H3,(H,25,26)/t13-,14-,15+,17+,18+,20-,21-/m0/s1 |
| InChIKey | XEXHGGJWBLYHQD-FXQXWWPZSA-N |
| Melting Point | 229-231C |
| Molecular Weight | 360.45 |
| Technique | KBr WAFER |