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A-HOMO-6-AZA-3-CHLOLESTEN-5,6A-DIONE
SpectraBase Compound ID Eo1cT8ahcG8
InChI InChI=1S/C27H43NO2/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(30)28-24(29)11-6-7-15-27(28,5)23(20)14-16-26(21,22)4/h6,11,18-23H,7-10,12-17H2,1-5H3/t19-,20+,21-,22+,23+,26-,27-/m1/s1
InChIKey UPSYLOLVKJIAJC-VHHOZFFRSA-N
Mol Weight 413.6 g/mol
Molecular Formula C27H43NO2
Exact Mass 413.32938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BnbuMYROjcp
Name A-Homo-6-aza-3-cholesten-5,6a-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H43NO2
InChI InChI=1S/C27H43NO2/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(30)28-24(29)11-6-7-15-27(28,5)23(20)14-16-26(21,22)4/h6,11,18-23H,7-10,12-17H2,1-5H3/t19-,20+,21-,22+,23+,26-,27-/m1/s1
InChIKey UPSYLOLVKJIAJC-VHHOZFFRSA-N
Molecular Weight 413.646 g/mol
SMILES [C@]12(N(C(C[C@]3([C@]4([C@](CC[C@]23[H])([C@](CC4)([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])=O)C(C=CCC1)=O)C
SPLASH splash10-0089-0409200000-df76bfec2e09fca57509
Source of Spectrum F2-44-844-13
Wiley ID 1639144