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2,4-Dichloro-N-isopropylbenzamide

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2,4-Dichloro-N-isopropylbenzamide
SpectraBase Compound ID Aq1f0RoLEmn
InChI InChI=1S/C10H11Cl2NO/c1-6(2)13-10(14)8-4-3-7(11)5-9(8)12/h3-6H,1-2H3,(H,13,14)
InChIKey OLOVOOIDPRZXNV-UHFFFAOYSA-N
Mol Weight 232.11 g/mol
Molecular Formula C10H11Cl2NO
Exact Mass 231.021769 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HxS0IjqWaR1
Name 2,4-Dichloro-N-isopropylbenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.021769377 u
Formula C10H11Cl2NO
InChI InChI=1S/C10H11Cl2NO/c1-6(2)13-10(14)8-4-3-7(11)5-9(8)12/h3-6H,1-2H3,(H,13,14)
InChIKey OLOVOOIDPRZXNV-UHFFFAOYSA-N
Molecular Weight 232.110 g/mol
SMILES C1(Cl)=C(C=CC(=C1)Cl)C(=O)NC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962472