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5.ALPHA.-ANDROSTAN-1-ONE-O-METHYLOXIME
SpectraBase Compound ID i2kduxoJEo
InChI InChI=1S/C20H33NO/c1-19-12-5-7-16(19)15-10-9-14-6-4-8-18(21-22-3)20(14,2)17(15)11-13-19/h14-17H,4-13H2,1-3H3/b21-18+/t14-,15+,16+,17+,19+,20+/m1/s1
InChIKey CZHSBQZRLQFYSZ-TZMFKZSQSA-N
Mol Weight 303.5 g/mol
Molecular Formula C20H33NO
Exact Mass 303.256215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LpAeb4PDDlk
Name 5.ALPHA.-ANDROSTAN-1-ONE-O-METHYLOXIME
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 303.256214686 u
Formula C20H33NO
InChI InChI=1S/C20H33NO/c1-19-12-5-7-16(19)15-10-9-14-6-4-8-18(21-22-3)20(14,2)17(15)11-13-19/h14-17H,4-13H2,1-3H3/b21-18+/t14-,15+,16+,17+,19+,20+/m1/s1
InChIKey CZHSBQZRLQFYSZ-TZMFKZSQSA-N
Molecular Weight 303.490 g/mol
Nominal Mass 303 u
Number of Peaks 76
SMILES C1C\C([C@@]2([C@]3(CC[C@@]4(CCC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])C)[H])C)=N/OC
SPLASH splash10-0fdo-5974000000-40c3313512caca4a4980
Source File Reference LMCM-54875-511F
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROSTAN-1-ONE O-METHYLOXIME (3aS,3bS,5aR,9aS,9bS,11aS,E)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-1-one O-methyl oxime
Wiley ID 4_645