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5β,17α-pregnane-3,20-dione

View entire compound with spectra: 2 FTIR

5β,17α-pregnane-3,20-dione
SpectraBase Compound ID 17DsTsR55pF
InChI InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14-,16+,17+,18+,19+,20+,21-/m1/s1
InChIKey XMRPGKVKISIQBV-BQMPSXOHSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ER7LYAdKgtj
Name 5β,17α-pregnane-3,20-dione
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 C21H32O2
InChI InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14-,16+,17+,18+,19+,20+,21-/m1/s1
InChIKey XMRPGKVKISIQBV-BQMPSXOHSA-N
Melting Point 103-103.5C
Molecular Weight 316.484985
Synonyms PREGNANE-3,20-DIONE, 5B,17A-,
Technique KBr WAFER