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(3E)-3-benzal-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one
SpectraBase Compound ID IyfTxJV70FQ
InChI InChI=1S/C22H15ClN2O/c23-17-11-12-19-18(14-17)21(16-9-5-2-6-10-16)24-20(22(26)25-19)13-15-7-3-1-4-8-15/h1-14,24H/b20-13+
InChIKey YXECFRGWUQKZIM-DEDYPNTBSA-N
Mol Weight 358.83 g/mol
Molecular Formula C22H15ClN2O
Exact Mass 358.087291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aEVH6ICJBg
Name (3E)-3-benzal-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one
Alternate Name(s) (3E)-3-benzylidene-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one (3E)-7-chloranyl-5-phenyl-3-(phenylmethylidene)-4H-1,4-benzodiazepin-2-one (3E)-7-chloro-5-phenyl-3-(phenylmethylene)-4H-1,4-benzodiazepin-2-one 3-Benzylidene-7-chloro-2,3-dihydro-5-phenyl-1H-1,4-benzodiazepin-2-one
CAS Registry Number 55056-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15ClN2O
InChI InChI=1S/C22H15ClN2O/c23-17-11-12-19-18(14-17)21(16-9-5-2-6-10-16)24-20(22(26)25-19)13-15-7-3-1-4-8-15/h1-14,24H/b20-13+
InChIKey YXECFRGWUQKZIM-DEDYPNTBSA-N
Molecular Weight 358.828 g/mol
SMILES N1\C(C(N=C2C=CC(=CC2=C1c1ccccc1)Cl)=O)=C\c1ccccc1
SPLASH splash10-0a6r-1329000000-6db3c3040219845e500e
Source of Spectrum HC-12-1391-0
Wiley ID 1347244