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4-[(2-Chloro-5-nitro-benzylidene)-amino]-benzamide

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

4-[(2-Chloro-5-nitro-benzylidene)-amino]-benzamide
SpectraBase Compound ID HcnDn4lVDjF
InChI InChI=1S/C14H10ClN3O3/c15-13-6-5-12(18(20)21)7-10(13)8-17-11-3-1-9(2-4-11)14(16)19/h1-8H,(H2,16,19)/b17-8+
InChIKey REUQLOXIHQTSBK-CAOOACKPSA-N
Mol Weight 303.71 g/mol
Molecular Formula C14H10ClN3O3
Exact Mass 303.041069 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5ecWxWmt7c7
Name 4-[(2-Chloro-5-nitro-benzylidene)-amino]-benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.041068891 u
Formula C14H10ClN3O3
InChI InChI=1S/C14H10ClN3O3/c15-13-6-5-12(18(20)21)7-10(13)8-17-11-3-1-9(2-4-11)14(16)19/h1-8H,(H2,16,19)/b17-8+
InChIKey REUQLOXIHQTSBK-CAOOACKPSA-N
Molecular Weight 303.705 g/mol
SMILES C1=CC(C(=O)N)=CC=C1\N=C\C1=CC(N(=O)=O)=CC=C1Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921893