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1H-1,4-Benzodiazepin-2(3H)-one, 7-chloro-1-ethyl-3-methyl-5-phenyl-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-1,4-Benzodiazepin-2(3H)-one, 7-chloro-1-ethyl-3-methyl-5-phenyl-
SpectraBase Compound ID HxcMAcQEnRb
InChI InChI=1S/C18H17ClN2O/c1-3-21-16-10-9-14(19)11-15(16)17(20-12(2)18(21)22)13-7-5-4-6-8-13/h4-12H,3H2,1-2H3
InChIKey FYQISGXZMZHGOY-UHFFFAOYSA-N
Mol Weight 312.8 g/mol
Molecular Formula C18H17ClN2O
Exact Mass 312.102941 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InOn5wp6yiG
Name 1H-1,4-Benzodiazepin-2(3H)-one, 7-chloro-1-ethyl-3-methyl-5-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.102940874 u
Formula C18H17ClN2O
InChI InChI=1S/C18H17ClN2O/c1-3-21-16-10-9-14(19)11-15(16)17(20-12(2)18(21)22)13-7-5-4-6-8-13/h4-12H,3H2,1-2H3
InChIKey FYQISGXZMZHGOY-UHFFFAOYSA-N
Molecular Weight 312.800 g/mol
SMILES C1(Cl)=CC=C2C(C(C3=CC=CC=C3)=NC(C(=O)N2CC)C)=C1