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4-(3,4-Diaminocarbonylphenyl)benzene-1,2-dicarboxamide

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

4-(3,4-Diaminocarbonylphenyl)benzene-1,2-dicarboxamide
SpectraBase Compound ID 4bS3DIjDjIi
InChI InChI=1S/C16H14N4O4/c17-13(21)9-3-1-7(5-11(9)15(19)23)8-2-4-10(14(18)22)12(6-8)16(20)24/h1-6H,(H2,17,21)(H2,18,22)(H2,19,23)(H2,20,24)
InChIKey YEHYDVISUFSQON-UHFFFAOYSA-N
Mol Weight 326.31 g/mol
Molecular Formula C16H14N4O4
Exact Mass 326.101505 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6UfoMYZC7hb
Name 4-(3,4-Diaminocarbonylphenyl)benzene-1,2-dicarboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.101504943 u
Formula C16H14N4O4
InChI InChI=1S/C16H14N4O4/c17-13(21)9-3-1-7(5-11(9)15(19)23)8-2-4-10(14(18)22)12(6-8)16(20)24/h1-6H,(H2,17,21)(H2,18,22)(H2,19,23)(H2,20,24)
InChIKey YEHYDVISUFSQON-UHFFFAOYSA-N
Molecular Weight 326.312 g/mol
SMILES C1(=CC(=C(C=C1)C(N)=O)C(N)=O)C1=CC(=C(C=C1)C(N)=O)C(N)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903593