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4-[1-(p-Bromoanilino)ethylidene]-1-phenyl-3,5-pyrazolidinedione

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

4-[1-(p-Bromoanilino)ethylidene]-1-phenyl-3,5-pyrazolidinedione
SpectraBase Compound ID AeNGR15vnO3
InChI InChI=1S/C17H14BrN3O2/c1-11(19-13-9-7-12(18)8-10-13)15-16(22)20-21(17(15)23)14-5-3-2-4-6-14/h2-10,19H,1H3,(H,20,22)
InChIKey HKLFKFUEPBWBTL-UHFFFAOYSA-N
Mol Weight 372.22 g/mol
Molecular Formula C17H14BrN3O2
Exact Mass 371.02694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5eFYkSMf7kh
Name 4-[1-(p-Bromoanilino)ethylidene]-1-phenyl-3,5-pyrazolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.026939701 u
Formula C17H14BrN3O2
InChI InChI=1S/C17H14BrN3O2/c1-11(19-13-9-7-12(18)8-10-13)15-16(22)20-21(17(15)23)14-5-3-2-4-6-14/h2-10,19H,1H3,(H,20,22)
InChIKey HKLFKFUEPBWBTL-UHFFFAOYSA-N
Molecular Weight 372.222 g/mol
SMILES N1N(C(C(=C(C)NC=2C=CC(=CC2)Br)C1=O)=O)C1=CC=CC=C1