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2-Chloro-5-iodo-N-pyridin-3-yl-benzamide

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

2-Chloro-5-iodo-N-pyridin-3-yl-benzamide
SpectraBase Compound ID LMRFVfaf4av
InChI InChI=1S/C12H8ClIN2O/c13-11-4-3-8(14)6-10(11)12(17)16-9-2-1-5-15-7-9/h1-7H,(H,16,17)
InChIKey UTWCGWYZJSBITH-UHFFFAOYSA-N
Mol Weight 358.57 g/mol
Molecular Formula C12H8ClIN2O
Exact Mass 357.936986 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 36MEaZ3Qnyk
Name 2-Chloro-5-iodo-N-pyridin-3-yl-benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 357.936985585 u
Formula C12H8ClIN2O
InChI InChI=1S/C12H8ClIN2O/c13-11-4-3-8(14)6-10(11)12(17)16-9-2-1-5-15-7-9/h1-7H,(H,16,17)
InChIKey UTWCGWYZJSBITH-UHFFFAOYSA-N
Molecular Weight 358.566 g/mol
SMILES C1(C(NC2=CC=CN=C2)=O)=C(C=CC(=C1)I)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912197