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2H-1,4-Benzodiazepin-2-one, 3-(acetyloxy)-7-bromo-5-(2-chlorophenyl)-1,3-dihydro-

View entire compound with spectra: 1 NMR

2H-1,4-Benzodiazepin-2-one, 3-(acetyloxy)-7-bromo-5-(2-chlorophenyl)-1,3-dihydro-
SpectraBase Compound ID 8XqcqGsyzSn
InChI InChI=1S/C17H12BrClN2O3/c1-9(22)24-17-16(23)20-14-7-6-10(18)8-12(14)15(21-17)11-4-2-3-5-13(11)19/h2-8,17H,1H3,(H,20,23)
InChIKey WFNOHKYMHSJTSM-UHFFFAOYSA-N
Mol Weight 407.65 g/mol
Molecular Formula C17H12BrClN2O3
Exact Mass 405.971983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KzIRy9JXUpv
Name 2H-1,4-Benzodiazepin-2-one, 3-(acetyloxy)-7-bromo-5-(2-chlorophenyl)-1,3-dihydro-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.971982951 u
Formula C17H12BrClN2O3
InChI InChI=1S/C17H12BrClN2O3/c1-9(22)24-17-16(23)20-14-7-6-10(18)8-12(14)15(21-17)11-4-2-3-5-13(11)19/h2-8,17H,1H3,(H,20,23)
InChIKey WFNOHKYMHSJTSM-UHFFFAOYSA-N
Molecular Weight 407.651 g/mol
SMILES C1=2NC(C(N=C(C2C=C(C=C1)Br)C1=CC=CC=C1Cl)OC(C)=O)=O