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(1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-(octylamino)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one

View entire compound with spectra: 1 MS (GC)

(1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-(octylamino)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
SpectraBase Compound ID 7an2rEkiBcM
InChI InChI=1S/C27H48N2O/c1-5-6-7-8-9-10-19-28-23-13-12-21-20-11-14-24-27(3,18-16-25(30)29(24)4)22(20)15-17-26(21,23)2/h20-24,28H,5-19H2,1-4H3/t20-,21-,22-,23-,24+,26-,27+/m0/s1
InChIKey DGQBENUVVPJBPV-QJDMKIOZSA-N
Mol Weight 416.7 g/mol
Molecular Formula C27H48N2O
Exact Mass 416.376664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPxKMKvODPA
Name (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-(octylamino)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48N2O
InChI InChI=1S/C27H48N2O/c1-5-6-7-8-9-10-19-28-23-13-12-21-20-11-14-24-27(3,18-16-25(30)29(24)4)22(20)15-17-26(21,23)2/h20-24,28H,5-19H2,1-4H3/t20-,21-,22-,23-,24+,26-,27+/m0/s1
InChIKey DGQBENUVVPJBPV-QJDMKIOZSA-N
Molecular Weight 416.694 g/mol
SMILES N([C@]1(CC[C@]2([C@@]3(CC[C@]4(N(C(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)C)[H])[H])[H])[H])CCCCCCCC
SPLASH splash10-014i-1902000000-04ee8b2d86492bc86c3b
Source of Spectrum E1-38-1165-15
Wiley ID 1598195