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Pregnanolone acetate

View entire compound with spectra: 4 NMR, 3 FTIR, 1 Raman, and 1 MS (GC)

Pregnanolone acetate
SpectraBase Compound ID DiTcPHJKZAg
InChI InChI=1S/C23H36O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h16-21H,5-13H2,1-4H3/t16-,17-,18+,19-,20+,21+,22+,23-/m1/s1
InChIKey GFHOQCXDABGYAL-LEQCJQSISA-N
Mol Weight 360.5 g/mol
Molecular Formula C23H36O3
Exact Mass 360.266445 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID DBZgpAv5Y2w
Name Pregnanolone acetate
Source of Sample J. J. Schneider, Jefferson Medical Center, Philadelphia, Pennsylvania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O3
InChI InChI=1S/C23H36O3/c1-14(24)19-7-8-20-18-6-5-16-13-17(26-15(2)25)9-11-22(16,3)21(18)10-12-23(19,20)4/h16-21H,5-13H2,1-4H3/t16-,17-,18+,19-,20+,21+,22+,23-/m1/s1
InChIKey GFHOQCXDABGYAL-LEQCJQSISA-N
Literature Reference J. ORG. CHEM. 33, 1707(1968)
Melting Point 101-103C
Molecular Weight 360.537994
Synonyms 5B-PREGNAN-20-ONE, 3A-HYDROXY-, ACETATE
Technique KBr WAFER