For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
10-Acetyl-11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID 8NkHcP3OnDd
InChI InChI=1S/C36H32Cl2N2O4/c1-3-43-34-20-25(12-17-33(34)44-21-23-8-13-27(37)14-9-23)36-35-30(39-29-6-4-5-7-31(29)40(36)22(2)41)18-26(19-32(35)42)24-10-15-28(38)16-11-24/h4-17,20,26,36,39H,3,18-19,21H2,1-2H3
InChIKey DIGWGDPLQSYITM-UHFFFAOYSA-N
Mol Weight 627.6 g/mol
Molecular Formula C36H32Cl2N2O4
Exact Mass 626.173913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2mHka1brs1F
Name 10-Acetyl-11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Alternate Name(s) 5-Acetyl-6-[4-(4-chlorobenzyl)oxy-3-ethoxy-phenyl]-9-(4-chlorophenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one 5-Acetyl-9-(4-chlorophenyl)-6-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one 9-(4-Chlorophenyl)-6-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]-5-ethanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H32Cl2N2O4
InChI InChI=1S/C36H32Cl2N2O4/c1-3-43-34-20-25(12-17-33(34)44-21-23-8-13-27(37)14-9-23)36-35-30(39-29-6-4-5-7-31(29)40(36)22(2)41)18-26(19-32(35)42)24-10-15-28(38)16-11-24/h4-17,20,26,36,39H,3,18-19,21H2,1-2H3
InChIKey DIGWGDPLQSYITM-UHFFFAOYSA-N
Molecular Weight 627.568 g/mol
SMILES N1c2ccccc2N(C(C2=C1CC(CC2=O)c1ccc(cc1)Cl)c1cc(OCC)c(cc1)OCc1ccc(cc1)Cl)C(=O)C
SPLASH splash10-004i-2931120000-c2db9146f8769e3a73d0
Wiley ID 1460344