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(8S,9S,10R,13S,14S,17S)-3-Chloro-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid tert-butylamide

View entire compound with spectra: 1 MS (GC)

(8S,9S,10R,13S,14S,17S)-3-Chloro-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid tert-butylamide
SpectraBase Compound ID FWrhvRq75yk
InChI InChI=1S/C24H36ClNO/c1-22(2,3)26-21(27)20-9-8-18-17-7-6-15-14-16(25)10-12-23(15,4)19(17)11-13-24(18,20)5/h6,14,17-20H,7-13H2,1-5H3,(H,26,27)/t17-,18-,19-,20+,23-,24-/m0/s1
InChIKey XTOKMXGBJJVUMG-ZEQQQVMLSA-N
Mol Weight 390.0 g/mol
Molecular Formula C24H36ClNO
Exact Mass 389.248542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fyzF9ZZDwt
Name (8S,9S,10R,13S,14S,17S)-3-Chloro-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid tert-butylamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36ClNO
InChI InChI=1S/C24H36ClNO/c1-22(2,3)26-21(27)20-9-8-18-17-7-6-15-14-16(25)10-12-23(15,4)19(17)11-13-24(18,20)5/h6,14,17-20H,7-13H2,1-5H3,(H,26,27)/t17-,18-,19-,20+,23-,24-/m0/s1
InChIKey XTOKMXGBJJVUMG-ZEQQQVMLSA-N
Molecular Weight 390.011 g/mol
SMILES N(C([C@@]1([C@@]2([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CCC(Cl)=C4)C)[H])(CC1)[H])C)[H])=O)C(C)(C)C
SPLASH splash10-0076-1109000000-579c32fd1d089f677cca
Source of Spectrum G2-4-58-9
Synonyms (N-1',1'-Dimethylethyl)-3-chloroandrost-3,5-diene-17.beta.carboxylate (8S,9S,10R,13S,14S,17S)-N-tert-butyl-3-chloranyl-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxamide
Wiley ID 1661635