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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-(3-methylbutyl)methanamide

View entire compound with spectra: 1 MS (GC)

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-(3-methylbutyl)methanamide
SpectraBase Compound ID J0OgayeU6n3
InChI InChI=1S/C25H42N2O2/c1-17(2)12-15-27(16-28)22-9-7-19-18-6-8-21-24(3,14-11-23(29)26(21)5)20(18)10-13-25(19,22)4/h16-22H,6-15H2,1-5H3/t18-,19-,20-,21+,22-,24+,25-/m0/s1
InChIKey WAICHBXZTLQXKX-WILZEYHLSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H42N2O2
Exact Mass 402.324629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35I4JLPnns
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-(3-methylbutyl)methanamide
Alternate Name(s) 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-(3-methylbutyl)formamide 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-isopentyl-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-isoamyl-formamide
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Formula C25H42N2O2
InChI InChI=1S/C25H42N2O2/c1-17(2)12-15-27(16-28)22-9-7-19-18-6-8-21-24(3,14-11-23(29)26(21)5)20(18)10-13-25(19,22)4/h16-22H,6-15H2,1-5H3/t18-,19-,20-,21+,22-,24+,25-/m0/s1
InChIKey WAICHBXZTLQXKX-WILZEYHLSA-N
Molecular Weight 402.623 g/mol
SMILES [C@@]12([C@](N(C)C(CC2)=O)(CC[C@]2([C@@]3(CC[C@@]([C@]3(CC[C@]12[H])C)(N(C=O)CCC(C)C)[H])[H])[H])[H])C
SPLASH splash10-0udi-5911100000-fc914a44a629c71292d0
Source of Spectrum E1-38-1168-36
Wiley ID 1598279