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1H-pyrido[4,3-b]indole, 2,3,4,4a,5,9b-hexahydro-2,8-dimethyl-5-[[5-(2-methylphenyl)-2H-tetrazol-2-yl]acetyl]-
SpectraBase Compound ID L3Y1DBJQA1G
InChI InChI=1S/C23H26N6O/c1-15-8-9-20-18(12-15)19-13-27(3)11-10-21(19)29(20)22(30)14-28-25-23(24-26-28)17-7-5-4-6-16(17)2/h4-9,12,19,21H,10-11,13-14H2,1-3H3
InChIKey LYLUJBCWPARIDH-UHFFFAOYSA-N
Mol Weight 402.5 g/mol
Molecular Formula C23H26N6O
Exact Mass 402.216809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gmH8QOXtW9
Name 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-2-[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]ethanone
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Formula C23H26N6O
InChI InChI=1S/C23H26N6O/c1-15-8-9-20-18(12-15)19-13-27(3)11-10-21(19)29(20)22(30)14-28-25-23(24-26-28)17-7-5-4-6-16(17)2/h4-9,12,19,21H,10-11,13-14H2,1-3H3
InChIKey LYLUJBCWPARIDH-UHFFFAOYSA-N
Molecular Weight 402.502 g/mol
SMILES c1ccc(-c2n[n](CC(N3C4C(CN(CC4)C)c4c3ccc(C)c4)=O)nn2)c(C)c1
SPLASH splash10-05fu-9400100000-afdcc77f97104cf95125
Synonyms 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-2-[5-(2-methylphenyl)-2-tetrazolyl]ethanone 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-2-[5-(2-methylphenyl)tetrazol-2-yl]ethanone 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-2-[5-(o-tolyl)tetrazol-2-yl]ethanone 1-(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrid[4,3-b]indol-5-yl)-2-[5-(o-tolyl)tetrazol-2-yl]ethanone
Wiley ID 1464230