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1-[8,9-dimethoxy-1-(4-methylphenyl)-6,10b-dihydro-5H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl]ethanone
SpectraBase Compound ID 5sxfe0huF5I
InChI InChI=1S/C21H23N3O3/c1-13-5-7-16(8-6-13)24-21-17-12-19(27-4)18(26-3)11-15(17)9-10-23(21)20(22-24)14(2)25/h5-8,11-12,21H,9-10H2,1-4H3/t21-/m1/s1
InChIKey XIFZHHRBADCEKA-OAQYLSRUSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITZSBJst7VJ
Name 1-[8,9-dimethoxy-1-(4-methylphenyl)-6,10b-dihydro-5H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O3
InChI InChI=1S/C21H23N3O3/c1-13-5-7-16(8-6-13)24-21-17-12-19(27-4)18(26-3)11-15(17)9-10-23(21)20(22-24)14(2)25/h5-8,11-12,21H,9-10H2,1-4H3/t21-/m1/s1
InChIKey XIFZHHRBADCEKA-OAQYLSRUSA-N
Molecular Weight 365.433 g/mol
SMILES [C@@]12(N(C(=NN2c2ccc(cc2)C)C(=O)C)CCc2cc(c(cc12)OC)OC)[H]
SPLASH splash10-03di-1109000000-183a741a65ff4a13af59
Source of Spectrum F-52-3454-6
Synonyms 1-[8,9-dimethoxy-1-(p-tolyl)-6,10b-dihydro-5H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl]ethanone 1-[8,9-dimethoxy-1-(p-tolyl)-6,10b-dihydro-5H-[1,2,4]triazol[3,4-a]isoquinolin-3-yl]ethanone 1-[(10bR)-8,9-dimethoxy-1-(p-tolyl)-6,10b-dihydro-5H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl]ethanone 1-[(10bR)-8,9-dimethoxy-1-(4-methylphenyl)-6,10b-dihydro-5H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl]ethanone
Wiley ID 795776