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11-[4-(dimethylamino)phenyl]-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 9l4zXBdWHH3
InChI InChI=1S/C28H29N3O2/c1-31(2)21-12-8-19(9-13-21)28-27-25(29-23-6-4-5-7-24(23)30-28)16-20(17-26(27)32)18-10-14-22(33-3)15-11-18/h4-15,20,28-30H,16-17H2,1-3H3
InChIKey LYLCHAAMYDNCQX-UHFFFAOYSA-N
Mol Weight 439.56 g/mol
Molecular Formula C28H29N3O2
Exact Mass 439.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Z3LAyw0eQ0
Name 11-[4-(dimethylamino)phenyl]-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Alternate Name(s) 6-(4-Dimethylaminophenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29N3O2
InChI InChI=1S/C28H29N3O2/c1-31(2)21-12-8-19(9-13-21)28-27-25(29-23-6-4-5-7-24(23)30-28)16-20(17-26(27)32)18-10-14-22(33-3)15-11-18/h4-15,20,28-30H,16-17H2,1-3H3
InChIKey LYLCHAAMYDNCQX-UHFFFAOYSA-N
Molecular Weight 439.559 g/mol
SMILES N1c2ccccc2NC(C2=C1CC(CC2=O)c1ccc(cc1)OC)c1ccc(cc1)N(C)C
SPLASH splash10-00tf-6910000000-404cd39a464a1facbc52
Wiley ID 1446676