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(1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-(4-nitroanilino)-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-(4-nitroanilino)-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
SpectraBase Compound ID 4qxc8bimngp
InChI InChI=1S/C25H35N3O3/c1-24-14-12-20-18(8-11-22-25(20,2)15-13-23(29)27(22)3)19(24)9-10-21(24)26-16-4-6-17(7-5-16)28(30)31/h4-7,18-22,26H,8-15H2,1-3H3/t18-,19-,20-,21-,22+,24-,25+/m0/s1
InChIKey RMORRQOSBCEHOX-BLZXGSKESA-N
Mol Weight 425.6 g/mol
Molecular Formula C25H35N3O3
Exact Mass 425.267842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KD7ws2cBToH
Name (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-(4-nitroanilino)-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 C25H35N3O3
InChI InChI=1S/C25H35N3O3/c1-24-14-12-20-18(8-11-22-25(20,2)15-13-23(29)27(22)3)19(24)9-10-21(24)26-16-4-6-17(7-5-16)28(30)31/h4-7,18-22,26H,8-15H2,1-3H3/t18-,19-,20-,21-,22+,24-,25+/m0/s1
InChIKey RMORRQOSBCEHOX-BLZXGSKESA-N
Molecular Weight 425.573 g/mol
SMILES N([C@@]1([C@]2(CC[C@@]3([C@@]4([C@](N(C)C(CC4)=O)(CC[C@]3([C@@]2(CC1)[H])[H])[H])C)[H])C)[H])c1ccc(N(=O)=O)cc1
SPLASH splash10-044r-3591200000-d571bd15c380a60392fa
Source of Spectrum E1-38-1166-25
Synonyms (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-[(4-nitrophenyl)amino]-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
Wiley ID 1598290