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3-Chloro-2-fluorobenzamide, N-(3-methylphenyl)-

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3-Chloro-2-fluorobenzamide, N-(3-methylphenyl)-
SpectraBase Compound ID 9dPPDRT4ynO
InChI InChI=1S/C14H11ClFNO/c1-9-4-2-5-10(8-9)17-14(18)11-6-3-7-12(15)13(11)16/h2-8H,1H3,(H,17,18)
InChIKey KQQJPHQPJVMMHF-UHFFFAOYSA-N
Mol Weight 263.7 g/mol
Molecular Formula C14H11ClFNO
Exact Mass 263.05132 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IIFPsLhB3JN
Name 3-Chloro-2-fluorobenzamide, N-(3-methylphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.051319840 u
Formula C14H11ClFNO
InChI InChI=1S/C14H11ClFNO/c1-9-4-2-5-10(8-9)17-14(18)11-6-3-7-12(15)13(11)16/h2-8H,1H3,(H,17,18)
InChIKey KQQJPHQPJVMMHF-UHFFFAOYSA-N
Molecular Weight 263.699 g/mol
SMILES C1=C(C(=C(C=C1)Cl)F)C(=O)NC=1C=CC=C(C)C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90659