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(5aR,10aR,12S)-5,10a,12-Trimethyl-5,5a,10,10a,11,12-hexahydro-benzo[6,7]azepino[3,2-b]indole
SpectraBase Compound ID CCpLFN37lM8
InChI InChI=1S/C19H22N2/c1-13-12-19(2)18(15-9-4-6-10-16(15)20-19)21(3)17-11-7-5-8-14(13)17/h4-11,13,18,20H,12H2,1-3H3/t13-,18+,19+/m0/s1
InChIKey XKRWTAQHXQAAHH-MJXNMMHHSA-N
Mol Weight 278.4 g/mol
Molecular Formula C19H22N2
Exact Mass 278.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsILOlLnOLR
Name (5aR,10aR,12S)-5,10a,12-Trimethyl-5,5a,10,10a,11,12-hexahydro-benzo[6,7]azepino[3,2-b]indole
Alternate Name(s) (5aR,7S,12aR)-5a,7,12-trimethyl-5,5a,6,7,12,12a-hexahydroindolo[3,2-b][1]benzazepine 2a,5,9-Trimethylindolo[2,3-b]benzazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2
InChI InChI=1S/C19H22N2/c1-13-12-19(2)18(15-9-4-6-10-16(15)20-19)21(3)17-11-7-5-8-14(13)17/h4-11,13,18,20H,12H2,1-3H3/t13-,18+,19+/m0/s1
InChIKey XKRWTAQHXQAAHH-MJXNMMHHSA-N
Molecular Weight 278.399 g/mol
SMILES N1c2c([C@@]3([C@]1(C[C@@](c1c(N3C)cccc1)(C)[H])C)[H])cccc2
SPLASH splash10-000x-0920000000-2320b2f80eec25d57447
Source of Spectrum AC-134-532-9
Wiley ID 812553