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ANDROST-5-ENE-7-ONE(7-O-METHYLOXIME)
SpectraBase Compound ID AxgfkiH0D9w
InChI InChI=1S/C20H31NO/c1-19-10-6-8-15(19)18-16(9-12-19)20(2)11-5-4-7-14(20)13-17(18)21-22-3/h13,15-16,18H,4-12H2,1-3H3/b21-17+/t15-,16-,18-,19-,20-/m0/s1
InChIKey CKKFLTDVNFUYML-ZAFVEXBJSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGamCaMMCdM
Name ANDROST-5-ENE-7-ONE(7-O-METHYLOXIME)
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 301.240564621 u
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-19-10-6-8-15(19)18-16(9-12-19)20(2)11-5-4-7-14(20)13-17(18)21-22-3/h13,15-16,18H,4-12H2,1-3H3/b21-17+/t15-,16-,18-,19-,20-/m0/s1
InChIKey CKKFLTDVNFUYML-ZAFVEXBJSA-N
Molecular Weight 301.474 g/mol
Nominal Mass 301 u
Number of Peaks 63
SMILES C1CC[C@@]2([C@]3(CC[C@@]4(CCC[C@]4([C@@]3(\C(C=C2C1)=N\OC)[H])[H])C)[H])C
SPLASH splash10-000i-0092000000-f08e1f7594c8cfa550c7
Source File Reference LMCM-58646-721V
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ANDROST-5-EN-7-ONE O-METHYLOXIME (3aS,3bS,9aR,9bS,11aS,Z)-10,13-dimethyl-3,4,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-7(2H)-one O-methyl oxime
Wiley ID 4_2506