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9-(4-Methoxyphenyl)-6-(4-pyridyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SpectraBase Compound ID 9MTMMSHFxu9
InChI InChI=1S/C25H23N3O2/c1-30-19-8-6-16(7-9-19)18-14-22-24(23(29)15-18)25(17-10-12-26-13-11-17)28-21-5-3-2-4-20(21)27-22/h2-13,18,25,27-28H,14-15H2,1H3
InChIKey JPSRTIPVKBXNMI-UHFFFAOYSA-N
Mol Weight 397.48 g/mol
Molecular Formula C25H23N3O2
Exact Mass 397.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQ2h0xUzsHr
Name 9-(4-Methoxyphenyl)-6-(4-pyridyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Alternate Name(s) 9-(4-Methoxyphenyl)-6-pyridin-4-yl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
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Formula C25H23N3O2
InChI InChI=1S/C25H23N3O2/c1-30-19-8-6-16(7-9-19)18-14-22-24(23(29)15-18)25(17-10-12-26-13-11-17)28-21-5-3-2-4-20(21)27-22/h2-13,18,25,27-28H,14-15H2,1H3
InChIKey JPSRTIPVKBXNMI-UHFFFAOYSA-N
Molecular Weight 397.478 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1ccc(cc1)OC)c1ccncc1
SPLASH splash10-014i-9328000000-f16a5e76ca463aab6471
Wiley ID 1453163