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Benzamide, 4-amino-N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)-

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

Benzamide, 4-amino-N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)-
SpectraBase Compound ID KFb3RsxIGTQ
InChI InChI=1S/C16H14N4O2/c17-12-8-6-11(7-9-12)16(22)18-14-10-15(21)20(19-14)13-4-2-1-3-5-13/h1-9H,10,17H2,(H,18,19,22)
InChIKey BBZPCXBBRMGHOQ-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C16H14N4O2
Exact Mass 294.111676 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4IOIfV3xtZd
Name Benzamide, 4-amino-N-(5-oxo-1-phenyl-2-pyrazolin-3-yl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.111675705 u
Formula C16H14N4O2
InChI InChI=1S/C16H14N4O2/c17-12-8-6-11(7-9-12)16(22)18-14-10-15(21)20(19-14)13-4-2-1-3-5-13/h1-9H,10,17H2,(H,18,19,22)
InChIKey BBZPCXBBRMGHOQ-UHFFFAOYSA-N
SMILES C1=CC=C(N2C(CC(=N2)NC(C2=CC=C(C=C2)N)=O)=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930351