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(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-anilino-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 MS (GC)

(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-anilino-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 5PR4Xhstmsm
InChI InChI=1S/C25H36N2O/c1-24-15-13-20-18(9-12-22-25(20,2)16-14-23(28)27(22)3)19(24)10-11-21(24)26-17-7-5-4-6-8-17/h4-8,18-22,26H,9-16H2,1-3H3/t18-,19-,20-,21-,22+,24-,25+/m0/s1
InChIKey RQNGZUMKXVKIKG-BLZXGSKESA-N
Mol Weight 380.6 g/mol
Molecular Formula C25H36N2O
Exact Mass 380.282764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Blkuvhm0za7
Name (1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-anilino-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
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36N2O
InChI InChI=1S/C25H36N2O/c1-24-15-13-20-18(9-12-22-25(20,2)16-14-23(28)27(22)3)19(24)10-11-21(24)26-17-7-5-4-6-8-17/h4-8,18-22,26H,9-16H2,1-3H3/t18-,19-,20-,21-,22+,24-,25+/m0/s1
InChIKey RQNGZUMKXVKIKG-BLZXGSKESA-N
Molecular Weight 380.576 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])c1ccccc1
SPLASH splash10-03ec-9501000000-ee370f411a28e7312ac8
Source of Spectrum E1-38-1166-24
Synonyms (1S,3aS,3bS,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-1-phenylazanyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
Wiley ID 1598291