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3-(3,4-Dimethoxyphenyl)-11-(3-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 5j6fc1LTxdp
InChI InChI=1S/C28H28N2O3/c1-17-7-6-8-19(13-17)28-27-23(29-21-9-4-5-10-22(21)30-28)14-20(15-24(27)31)18-11-12-25(32-2)26(16-18)33-3/h4-13,16,20,28-30H,14-15H2,1-3H3
InChIKey AMBPRWLLGRGDJA-UHFFFAOYSA-N
Mol Weight 440.54 g/mol
Molecular Formula C28H28N2O3
Exact Mass 440.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gWJeg9Hoey
Name 3-(3,4-Dimethoxyphenyl)-11-(3-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Alternate Name(s) 9-(3,4-dimethoxyphenyl)-6-(3-methylphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one 9-(3,4-dimethoxyphenyl)-6-(m-tolyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
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Formula C28H28N2O3
InChI InChI=1S/C28H28N2O3/c1-17-7-6-8-19(13-17)28-27-23(29-21-9-4-5-10-22(21)30-28)14-20(15-24(27)31)18-11-12-25(32-2)26(16-18)33-3/h4-13,16,20,28-30H,14-15H2,1-3H3
InChIKey AMBPRWLLGRGDJA-UHFFFAOYSA-N
Molecular Weight 440.543 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1cc(OC)c(cc1)OC)c1cc(C)ccc1
SPLASH splash10-0002-2976100000-6b53a7de10d1ab3d1c92
Wiley ID 1455042