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5-Oxo-1-phenyl-pyrrolidine-3-carboxylic acid (4-bromo-benzylidene)-hydrazide

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5-Oxo-1-phenyl-pyrrolidine-3-carboxylic acid (4-bromo-benzylidene)-hydrazide
SpectraBase Compound ID 3hzlDDP1fel
InChI InChI=1S/C18H16BrN3O2/c19-15-8-6-13(7-9-15)11-20-21-18(24)14-10-17(23)22(12-14)16-4-2-1-3-5-16/h1-9,11,14H,10,12H2,(H,21,24)/b20-11+
InChIKey LWTIFBHJAVNUHK-RGVLZGJSSA-N
Mol Weight 386.25 g/mol
Molecular Formula C18H16BrN3O2
Exact Mass 385.04259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HByGclJuAUH
Name 5-oxo-1-Phenyl-pyrrolidine-3-carboxylic acid (4-bromo-benzylidene)-hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.042589765 u
Formula C18H16BrN3O2
InChI InChI=1S/C18H16BrN3O2/c19-15-8-6-13(7-9-15)11-20-21-18(24)14-10-17(23)22(12-14)16-4-2-1-3-5-16/h1-9,11,14H,10,12H2,(H,21,24)/b20-11+
InChIKey LWTIFBHJAVNUHK-RGVLZGJSSA-N
Molecular Weight 386.249 g/mol
SMILES C1=CC=C(N2C(CC(C2)C(N\N=C\C2=CC=C(C=C2)Br)=O)=O)C=C1