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10-Acetyl-11-(4-ethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID BDsR35wwLiq
InChI InChI=1S/C25H28N2O3/c1-5-30-18-12-10-17(11-13-18)24-23-20(14-25(3,4)15-22(23)29)26-19-8-6-7-9-21(19)27(24)16(2)28/h6-13,24,26H,5,14-15H2,1-4H3
InChIKey QZENSVBYISWGMT-UHFFFAOYSA-N
Mol Weight 404.51 g/mol
Molecular Formula C25H28N2O3
Exact Mass 404.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NWdazYGIoE
Name 10-Acetyl-11-(4-ethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O3
InChI InChI=1S/C25H28N2O3/c1-5-30-18-12-10-17(11-13-18)24-23-20(14-25(3,4)15-22(23)29)26-19-8-6-7-9-21(19)27(24)16(2)28/h6-13,24,26H,5,14-15H2,1-4H3
InChIKey QZENSVBYISWGMT-UHFFFAOYSA-N
Molecular Weight 404.510 g/mol
SMILES N1c2c(N(C(C3=C1CC(CC3=O)(C)C)c1ccc(cc1)OCC)C(=O)C)cccc2
SPLASH splash10-0007-7495100000-1fc6a8897e861c387270
Synonyms 5-Acetyl-6-(4-ethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one 5-Acetyl-9,9-dimethyl-6-p-phenetyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one 5-Ethanoyl-6-(4-ethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
Wiley ID 1438691