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(8R,9S,10R,13S,14S)-17-(3,3-Dimethyl-butyryl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-17-aza-cyclopenta[a]phenanthren-3-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(8R,9S,10R,13S,14S)-17-(3,3-Dimethyl-butyryl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-17-aza-cyclopenta[a]phenanthren-3-one
SpectraBase Compound ID 9zAXuqszfVz
InChI InChI=1S/C24H37NO2/c1-22(2,3)15-21(27)25-13-10-20-18-7-6-16-14-17(26)8-11-23(16,4)19(18)9-12-24(20,25)5/h14,18-20H,6-13,15H2,1-5H3/t18-,19+,20+,23+,24+/m1/s1
InChIKey JGNSAEFOSKOBFA-IKMTZZNFSA-N
Mol Weight 371.6 g/mol
Molecular Formula C24H37NO2
Exact Mass 371.282429 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4TQFQoTLQCO
Name (8R,9S,10R,13S,14S)-17-(3,3-Dimethyl-butyryl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-17-aza-cyclopenta[A]phenanthren-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.282429433 u
Formula C24H37NO2
InChI InChI=1S/C24H37NO2/c1-22(2,3)15-21(27)25-13-10-20-18-7-6-16-14-17(26)8-11-23(16,4)19(18)9-12-24(20,25)5/h14,18-20H,6-13,15H2,1-5H3/t18-,19+,20+,23+,24+/m1/s1
InChIKey JGNSAEFOSKOBFA-IKMTZZNFSA-N
Molecular Weight 371.565 g/mol
SMILES [C@@]12(N(CC[C@]2([C@@]2(CCC=3[C@@]([C@]2(CC1)[H])(CCC(=O)C3)C)[H])[H])C(CC(C)(C)C)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927202