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Androsta-3,5-dien-7-one
SpectraBase Compound ID 7byY42QeEM7
InChI InChI=1S/C19H26O/c1-18-9-5-7-14(18)17-15(8-11-18)19(2)10-4-3-6-13(19)12-16(17)20/h3,6,12,14-15,17H,4-5,7-11H2,1-2H3
InChIKey KTFHYOMAVCUFEY-UHFFFAOYSA-N
Mol Weight 270.42 g/mol
Molecular Formula C19H26O
Exact Mass 270.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYMCQ5Tz7cV
Name ANDROSTA-3,5-DIENE-7-ONE
Alternate Name(s) ANDROSTA-3,5-DIEN-7-ONE
CAS Registry Number 32222-21-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H26O
InChI InChI=1S/C19H26O/c1-18-9-5-7-14(18)17-15(8-11-18)19(2)10-4-3-6-13(19)12-16(17)20/h3,6,12,14-15,17H,4-5,7-11H2,1-2H3
InChIKey KTFHYOMAVCUFEY-UHFFFAOYSA-N
Nominal Mass 270 u
Owner Database Compilation (C) 2005 Wiley & Sons, Inc.
SMILES C12CCC3(C(CCC3)C1C(C=C1C=CCCC21C)=O)C
SPLASH splash10-05fr-2950000000-be82d1e310767438c0ed
Source File Reference LMCM-94782-858C
Source of Spectrum Copyright (C) Dr. Makin, London Hospital Medical College, UK