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(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-(4-methoxyanilino)-6,9a,11a-trimethyl-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 NMR, and 1 MS (GC)

(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-(4-methoxyanilino)-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
SpectraBase Compound ID 78PhIMSMv7J
InChI InChI=1S/C26H38N2O2/c1-25-15-13-21-19(9-12-23-26(21,2)16-14-24(29)28(23)3)20(25)10-11-22(25)27-17-5-7-18(30-4)8-6-17/h5-8,19-23,27H,9-16H2,1-4H3/t19-,20-,21-,22-,23+,25-,26+/m0/s1
InChIKey HRLOOARZKHKROA-LOIFCEGPSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H38N2O2
Exact Mass 410.293328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1LLQqGMoN2q
Name (1S,3as,3bs,5ar,9ar,9bs,11As)-1-(4-methoxyanilino)-6,9A,11A-trimethyl-2,3,3A,3B,4,5,5A,8,9,9B,10,11-dodecahydro-1H-indeno[5,4-F]quinolin-7-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.293328470 u
Formula C26H38N2O2
InChI InChI=1S/C26H38N2O2/c1-25-15-13-21-19(9-12-23-26(21,2)16-14-24(29)28(23)3)20(25)10-11-22(25)27-17-5-7-18(30-4)8-6-17/h5-8,19-23,27H,9-16H2,1-4H3/t19-,20-,21-,22-,23+,25-,26+/m0/s1
InChIKey HRLOOARZKHKROA-LOIFCEGPSA-N
Molecular Weight 410.602 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)(NC=1C=CC(=CC1)OC)[H])[H])[H])[H])C