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20β,21-dihydroxypregna-5,16-dien-3-one, cyclic ethylene acetal
SpectraBase Compound ID IzbnFSycU4k
InChI InChI=1S/C23H34O4/c1-21-9-10-23(26-11-12-27-23)13-15(21)3-4-16-17-5-6-19(20(25)14-24)22(17,2)8-7-18(16)21/h3,6,16-18,20,24-25H,4-5,7-14H2,1-2H3/t16-,17-,18-,20+,21-,22-/m0/s1
InChIKey MVIKZUPCYGTBIM-WTNOFXFJSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CVlyn7vE28C
Name 20β,21-dihydroxypregna-5,16-dien-3-one, cyclic ethylene acetal
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
CAS Registry Number 39703-41-8
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-21-9-10-23(26-11-12-27-23)13-15(21)3-4-16-17-5-6-19(20(25)14-24)22(17,2)8-7-18(16)21/h3,6,16-18,20,24-25H,4-5,7-14H2,1-2H3/t16-,17-,18-,20+,21-,22-/m0/s1
InChIKey MVIKZUPCYGTBIM-WTNOFXFJSA-N
Literature Reference J. ORG. CHEM. 38, 2335(1973) Abstract-Chemical Abstracts= 79, 42738(1973)
Melting Point 198-200C
Molecular Weight 374.520996
Synonyms PREGNA-5,16-DIEN-3-ONE, 20B,21-DI- HYDROXY-, CYCLIC ETHYLENE ACETAL
Technique KBr WAFER