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3-(3,4-dimethoxyphenyl)-11-(3-pyridinyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

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3-(3,4-dimethoxyphenyl)-11-(3-pyridinyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID DgI82sCPBYJ
InChI InChI=1S/C26H25N3O3/c1-31-23-10-9-16(14-24(23)32-2)18-12-21-25(22(30)13-18)26(17-6-5-11-27-15-17)29-20-8-4-3-7-19(20)28-21/h3-11,14-15,18,26,28-29H,12-13H2,1-2H3
InChIKey BMGCNEXJQXCUPY-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C26H25N3O3
Exact Mass 427.189592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B79gmINrts7
Name 9-(3,4-dimethoxyphenyl)-6-(3-pyridinyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Alternate Name(s) 9-(3,4-dimethoxyphenyl)-6-(3-pyridyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one 9-(3,4-dimethoxyphenyl)-6-pyridin-3-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
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Formula C26H25N3O3
InChI InChI=1S/C26H25N3O3/c1-31-23-10-9-16(14-24(23)32-2)18-12-21-25(22(30)13-18)26(17-6-5-11-27-15-17)29-20-8-4-3-7-19(20)28-21/h3-11,14-15,18,26,28-29H,12-13H2,1-2H3
InChIKey BMGCNEXJQXCUPY-UHFFFAOYSA-N
Molecular Weight 427.504 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1cc(OC)c(cc1)OC)c1cnccc1
SPLASH splash10-0006-9522000000-76636d3d923efb10cc63
Wiley ID 1448195