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(8R,9S,13S,14S)-13-Methyl-3-((phenylamino)methyl)-6,7,8,9,11,12,13,14,15,16-decahydro-17H-cyclopenta[a]phenanthren-17-one
SpectraBase Compound ID 51tYQs17sUC
InChI InChI=1S/C25H29NO/c1-25-14-13-21-20-9-7-17(16-26-19-5-3-2-4-6-19)15-18(20)8-10-22(21)23(25)11-12-24(25)27/h2-7,9,15,21-23,26H,8,10-14,16H2,1H3/t21-,22-,23+,25+/m1/s1
InChIKey SXNGPDQZMIBKSW-AHCIIZGASA-N
Mol Weight 359.51 g/mol
Molecular Formula C25H29NO
Exact Mass 359.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bCHHsj6l0A
Name (8R,9S,13S,14S)-13-Methyl-3-((phenylamino)methyl)-6,7,8,9,11,12,13,14,15,16-decahydro-17H-cyclopenta[a]phenanthren-17-one
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.224914557 u
Formula C25H29NO
InChI InChI=1S/C25H29NO/c1-25-14-13-21-20-9-7-17(16-26-19-5-3-2-4-6-19)15-18(20)8-10-22(21)23(25)11-12-24(25)27/h2-7,9,15,21-23,26H,8,10-14,16H2,1H3/t21-,22-,23+,25+/m1/s1
InChIKey SXNGPDQZMIBKSW-AHCIIZGASA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604452
Molecular Weight 359.513 g/mol
Quality 37
SMILES N(CC1=CC=2CC[C@@]3([C@](CC[C@@]4(C)[C@]3(CCC4=O)[H])(C2C=C1)[H])[H])C1=CC=CC=C1
SPLASH splash10-07vi-0955000000-bb77dc31f09607f36fb5
Source of Spectrum QE-22-SM9-3m (DOI: 10.1002/chem.201604452)
Wiley ID 1905295