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2H-1,4-Benzodiazepin-2-one, 7-chloro-1-[2-(ethenylmethylamino)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-
SpectraBase Compound ID BAhMETXO6tP
InChI InChI=1S/C20H19ClFN3O/c1-3-24(2)10-11-25-18-9-8-14(21)12-16(18)20(23-13-19(25)26)15-6-4-5-7-17(15)22/h3-9,12H,1,10-11,13H2,2H3
InChIKey WTHVFIMUYBGYCY-UHFFFAOYSA-N
Mol Weight 371.84 g/mol
Molecular Formula C20H19ClFN3O
Exact Mass 371.120068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FneqkfLo2H0
Name 2H-1,4-Benzodiazepin-2-one, 7-chloro-1-[2-(ethenylmethylamino)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.120068106 u
Formula C20H19ClFN3O
InChI InChI=1S/C20H19ClFN3O/c1-3-24(2)10-11-25-18-9-8-14(21)12-16(18)20(23-13-19(25)26)15-6-4-5-7-17(15)22/h3-9,12H,1,10-11,13H2,2H3
InChIKey WTHVFIMUYBGYCY-UHFFFAOYSA-N
Molecular Weight 371.843 g/mol
SMILES C=1(C=2C(N(CCN(C=C)C)C(CN1)=O)=CC=C(C2)Cl)C=1C(F)=CC=CC1