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4-NOR-3,5-SECOANDROSTAN-17.BETA.-OL-3,5-DIONE(3,5-DI-O-METHYLOXIME-17.BETA.-PROPIONATE)
SpectraBase Compound ID Jd3FxxDPpw3
InChI InChI=1S/C23H36N2O4/c1-6-20(26)29-19-8-7-16-14-13-15-18(24-27-4)10-12-23(3,21(15)25-28-5)17(14)9-11-22(16,19)2/h14-17,19H,6-13H2,1-5H3/b24-18-,25-21-/t14-,15+,16-,17-,19-,22-,23+/m0/s1
InChIKey QFQVZPNIFSZGJM-BDKJFTROSA-N
Mol Weight 404.6 g/mol
Molecular Formula C23H36N2O4
Exact Mass 404.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E24OEPi4MD
Name 4-NOR-3,5-SECOANDROSTAN-17.BETA.-OL-3,5-DIONE(3,5-DI-O-METHYLOXIME-17.BETA.-PROPIONATE)
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 404.267507643 u
Formula C23H36N2O4
InChI InChI=1S/C23H36N2O4/c1-6-20(26)29-19-8-7-16-14-13-15-18(24-27-4)10-12-23(3,21(15)25-28-5)17(14)9-11-22(16,19)2/h14-17,19H,6-13H2,1-5H3/b24-18-,25-21-/t14-,15+,16-,17-,19-,22-,23+/m0/s1
InChIKey QFQVZPNIFSZGJM-BDKJFTROSA-N
Molecular Weight 404.551 g/mol
Nominal Mass 404 u
Number of Peaks 56
SMILES C1\C([C@]2(C[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@@]3([C@@](C1)(\C2=N/OC)C)[H])C)(OC(=O)CC)[H])[H])[H])[H])=N\OC
SPLASH splash10-05fr-5917100000-df3073e3d5fac34c71ad
Source File Reference LMCM-95157-820M
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Wiley ID 4_1636