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6β-hydroxy-3,5-cyclopregnan-20-one

View entire compound with spectra: 2 NMR, and 1 FTIR

6β-hydroxy-3,5-cyclopregnan-20-one
SpectraBase Compound ID 7mn8WdPcLv2
InChI InChI=1S/C21H32O2/c1-12(22)15-4-5-16-14-10-18(23)21-11-13(21)6-9-20(21,3)17(14)7-8-19(15,16)2/h13-18,23H,4-11H2,1-3H3/t13?,14-,15+,16-,17-,18+,19+,20+,21?/m0/s1
InChIKey UGIARLNNAPRCPF-VMOOXPTGSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BafdgqgXDqq
Name 6β-hydroxy-3,5-cyclopregnan-20-one
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment; Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-12(22)15-4-5-16-14-10-18(23)21-11-13(21)6-9-20(21,3)17(14)7-8-19(15,16)2/h13-18,23H,4-11H2,1-3H3/t13?,14-,15+,16-,17-,18+,19+,20+,21?/m0/s1
InChIKey UGIARLNNAPRCPF-VMOOXPTGSA-N
Molecular Weight 316.49
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20