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cis-11β, 21-dihydroxypregna-4,17(20)-dien-3-one

View entire compound with spectra: 1 NMR, 3 FTIR, and 1 Raman

cis-11β, 21-dihydroxypregna-4,17(20)-dien-3-one
SpectraBase Compound ID 7KsuYD0VcaR
InChI InChI=1S/C21H30O3/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,11,16-19,22,24H,3-7,9-10,12H2,1-2H3/b13-8+/t16-,17-,18-,19+,20-,21+/m0/s1
InChIKey SBMHTRUNPKWTLU-QMERZLORSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 33ZSxCCay3R
Name cis-11β, 21-dihydroxypregna-4,17(20)-dien-3-one
Source of Sample J. J. Schneider, Jefferson Medical Center, Philadelphia, Pennsylvania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-20-9-7-15(23)11-14(20)3-5-16-17-6-4-13(8-10-22)21(17,2)12-18(24)19(16)20/h8,11,16-19,22,24H,3-7,9-10,12H2,1-2H3/b13-8+/t16-,17-,18-,19+,20-,21+/m0/s1
InChIKey SBMHTRUNPKWTLU-QMERZLORSA-N
Molecular Weight 330.467987
Synonyms PREGNA-4,17/20/-DIEN-3-ONE, 11B,21-DIHYDROXY-, CIS-,
Technique KBr WAFER