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20β,21-dihydroxypregn-4-en-3-one, 21-(methyl carbonate)
SpectraBase Compound ID E6kYJsPsXdc
InChI InChI=1S/C23H34O5/c1-22-10-8-15(24)12-14(22)4-5-16-17-6-7-19(20(25)13-28-21(26)27-3)23(17,2)11-9-18(16)22/h12,16-20,25H,4-11,13H2,1-3H3/t16-,17-,18-,19+,20+,22-,23-/m0/s1
InChIKey COKZBYNJEDXNGT-UMDFJOQQSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9uH7oKuQYii
Name 20β,21-dihydroxypregn-4-en-3-one, 21-(methyl carbonate)
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
CAS Registry Number 39703-98-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-22-10-8-15(24)12-14(22)4-5-16-17-6-7-19(20(25)13-28-21(26)27-3)23(17,2)11-9-18(16)22/h12,16-20,25H,4-11,13H2,1-3H3/t16-,17-,18-,19+,20+,22-,23-/m0/s1
InChIKey COKZBYNJEDXNGT-UMDFJOQQSA-N
Literature Reference J. ORG. CHEM. 38, 2335(1973)
Melting Point 191-192C
Molecular Weight 390.519989
Synonyms PREGN-4-EN-3-ONE, 20B,21-DI- HYDROXY-, 21-/METHYL CARBONATE/
Technique KBr WAFER