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5β-androst-1-ene-3,11,17-trione

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

5β-androst-1-ene-3,11,17-trione
SpectraBase Compound ID 2MpSJZrq2yV
InChI InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-8,11,13-14,17H,3-6,9-10H2,1-2H3/t11-,13+,14+,17-,18+,19+/m1/s1
InChIKey NYLSQMMWVJMFFO-KKAFLPRUSA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KWEIK6zSDHp
Name 5β-androst-1-ene-3,11,17-trione
Source of Sample J. J. Schneider, Jefferson Medical Center, Philadelphia, Pennsylvania
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-8,11,13-14,17H,3-6,9-10H2,1-2H3/t11-,13+,14+,17-,18+,19+/m1/s1
InChIKey NYLSQMMWVJMFFO-KKAFLPRUSA-N
Literature Reference J. ORG. CHEM. 33, 3118(1968) Abstract-Chemical Abstracts= 69, 52415(1968)
Melting Point 181-182C
Molecular Weight 300.398010
Synonyms 5B-ANDROST-1-ENE-3,11,17-TRIONE
Technique KBr WAFER