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1.ALPHA.-METHYLANDROST-4-ENE-3,17-DIONE
SpectraBase Compound ID Cszzw1SqYKe
InChI InChI=1S/C20H28O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h11-12,15-17H,4-10H2,1-3H3/t12-,15-,16-,17-,19-,20-/m0/s1
InChIKey OYGFFDKBBBWEGR-WAYFEFRKSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcaWn6QshKH
Name 1.ALPHA.-METHYLANDROST-4-ENE-3,17-DIONE
CAS Registry Number 4136-62-3
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 300.208930140 u
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h11-12,15-17H,4-10H2,1-3H3/t12-,15-,16-,17-,19-,20-/m0/s1
InChIKey OYGFFDKBBBWEGR-WAYFEFRKSA-N
Molecular Weight 300.442 g/mol
Nominal Mass 300 u
Number of Peaks 189
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)(C)[H])=O
SPLASH splash10-0zfr-5954000000-930baa15da2aa5023d90
Source File Reference LMCM-67030-727G
Source of Spectrum Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany
Synonyms 1-METHYLANDROST-4-ENE-3,17-DIONE 4-ANDROSTEN-3,17-DION, 1-ALPHA-METHYL- (1S,2R,3S,10R,11S,15S)-2,3,15-trimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-6-ene-5,14-dione
Wiley ID 8_24839