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N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxidanylidene-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-N-cyclohexyl-methanamide
SpectraBase Compound ID 2DiwZQOS8a9
InChI InChI=1S/C26H42N2O2/c1-25-16-14-24(30)27(3)22(25)11-9-19-20-10-12-23(26(20,2)15-13-21(19)25)28(17-29)18-7-5-4-6-8-18/h17-23H,4-16H2,1-3H3/t19-,20-,21-,22+,23-,25+,26-/m0/s1
InChIKey GWOHHTZQGRQPDS-LMZXXRHXSA-N
Mol Weight 414.6 g/mol
Molecular Formula C26H42N2O2
Exact Mass 414.324629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23En1fL7gdX
Name N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxidanylidene-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-N-cyclohexyl-methanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42N2O2
InChI InChI=1S/C26H42N2O2/c1-25-16-14-24(30)27(3)22(25)11-9-19-20-10-12-23(26(20,2)15-13-21(19)25)28(17-29)18-7-5-4-6-8-18/h17-23H,4-16H2,1-3H3/t19-,20-,21-,22+,23-,25+,26-/m0/s1
InChIKey GWOHHTZQGRQPDS-LMZXXRHXSA-N
Molecular Weight 414.634 g/mol
SMILES C1(CC[C@]2([C@](N1C)(CC[C@]1([C@@]3(CC[C@@]([C@@]3(C)CC[C@]21[H])(N(C=O)C1CCCCC1)[H])[H])[H])[H])C)=O
SPLASH splash10-0a4i-9400000000-f861bd0364e366251d67
Source of Spectrum E1-38-1168-40
Synonyms N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-N-cyclohexyl-formamide N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-7-keto-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-N-cyclohexyl-formamide
Wiley ID 1598275