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5alpha-ANDROSTAN-17-ONE
SpectraBase Compound ID JODSxfM2GVB
InChI InChI=1S/C19H30O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h13-16H,3-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1
InChIKey YJDYCULVYZDESB-HKQXQEGQSA-N
Mol Weight 274.45 g/mol
Molecular Formula C19H30O
Exact Mass 274.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpDNl5uX6Bg
Name 5.ALPHA.-ANDROSTAN-17-ONE
CAS Registry Number 963-74-6
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 274.229665585 u
Formula C19H30O
InChI InChI=1S/C19H30O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h13-16H,3-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1
InChIKey YJDYCULVYZDESB-HKQXQEGQSA-N
Molecular Weight 274.448 g/mol
Nominal Mass 274 u
Number of Peaks 102
SMILES C1CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])=O)C)[H])C
SPLASH splash10-00yi-5690000000-eb6b6d4a58331b9af6f2
Source File Reference LMCM-70365-047B
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROSTAN-17-ONE, (5.ALPHA.)- ANDROSTAN-17-ONE (5R,8R,9S,10S,13S,14S)-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
Wiley ID 4_2836