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1,4-Androstadien-3,17-dione
SpectraBase Compound ID 4CXkYybt770
InChI InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
InChIKey LUJVUUWNAPIQQI-QAGGRKNESA-N
Mol Weight 284.4 g/mol
Molecular Formula C19H24O2
Exact Mass 284.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tGtgv0Hmqh
Name ANDROSTA-1,4-DIENE-3,17-DIONE
CAS Registry Number 897-06-3
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 284.177630011 u
Formula C19H24O2
InChI InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1
InChIKey LUJVUUWNAPIQQI-QAGGRKNESA-N
Molecular Weight 284.399 g/mol
Nominal Mass 284 u
Number of Peaks 72
SMILES C1(C=C[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CCC2=C1)[H])[H])=O)C)[H])C)=O
SPLASH splash10-00di-2910000000-03122a927b1ecc05ea93
Source File Reference LMCM-90267-668W
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms (8R,9S,10R,13S,14S)-10,13-dimethyl-7,8,9,10,11,12,13,14,15,16-decahydro-3H-cyclopenta[a]phenanthrene-3,17(6H)-dione
Wiley ID 4_1417