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ANDROSTAN-15-ONE
SpectraBase Compound ID 1YF0QL2h8mO
InChI InChI=1S/C19H30O/c1-18-11-8-15-14(17(18)16(20)9-12-18)7-6-13-5-3-4-10-19(13,15)2/h13-15,17H,3-12H2,1-2H3/t13-,14-,15+,17+,18-,19+/m1/s1
InChIKey GFIHCUMZMSPMBT-OMEKBDSISA-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 CKm2flA9Pny
Name 5.ALPHA.,14.BETA.-ANDROSTAN-15-ONE
CAS Registry Number 734-69-0
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 274.229665585 u
Formula C19H30O
InChI InChI=1S/C19H30O/c1-18-11-8-15-14(17(18)16(20)9-12-18)7-6-13-5-3-4-10-19(13,15)2/h13-15,17H,3-12H2,1-2H3/t13-,14-,15+,17+,18-,19+/m1/s1
InChIKey GFIHCUMZMSPMBT-OMEKBDSISA-N
Molecular Weight 274.448 g/mol
Nominal Mass 274 u
Number of Peaks 112
SMILES C1CC[C@@]2([C@]3(CC[C@@]4(CCC([C@@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])=O)C)[H])C
SPLASH splash10-052b-9450000000-6b061f51c7a5ae0e13cd
Source File Reference LMCM-62419-783G
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROSTAN-15-ONE (5R,8R,9S,10S,13R,14R)-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-15(2H)-one
Wiley ID 4_2050