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7-Bromo-5-(4-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one

View entire compound with spectra: 1 NMR

7-Bromo-5-(4-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one
SpectraBase Compound ID A0v6YlmX52N
InChI InChI=1S/C15H10BrClN2O/c16-10-3-6-13-12(7-10)15(18-8-14(20)19-13)9-1-4-11(17)5-2-9/h1-7H,8H2,(H,19,20)
InChIKey FQYRORMVHGPLMS-UHFFFAOYSA-N
Mol Weight 349.62 g/mol
Molecular Formula C15H10BrClN2O
Exact Mass 347.966504 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LneQfX3qCiH
Name 7-Bromo-5-(4-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one
Comments Computed using HOSE algorithm
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Exact Mass 347.966503649 u
Formula C15H10BrClN2O
InChI InChI=1S/C15H10BrClN2O/c16-10-3-6-13-12(7-10)15(18-8-14(20)19-13)9-1-4-11(17)5-2-9/h1-7H,8H2,(H,19,20)
InChIKey FQYRORMVHGPLMS-UHFFFAOYSA-N
Molecular Weight 349.615 g/mol
SMILES C1=2C(=NCC(NC2C=CC(=C1)Br)=O)C1=CC=C(C=C1)Cl