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N-(3,4-Dichlorophenyl)-2-methylbutanamide

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N-(3,4-Dichlorophenyl)-2-methylbutanamide
SpectraBase Compound ID 8c6DDOeDjEL
InChI InChI=1S/C11H13Cl2NO/c1-3-7(2)11(15)14-8-4-5-9(12)10(13)6-8/h4-7H,3H2,1-2H3,(H,14,15)
InChIKey GREVJEWXSUUOOV-UHFFFAOYSA-N
Mol Weight 246.14 g/mol
Molecular Formula C11H13Cl2NO
Exact Mass 245.037419 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9Dl5YGbBtVk
Name N-(3,4-Dichlorophenyl)-2-methylbutanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.037419442 u
Formula C11H13Cl2NO
InChI InChI=1S/C11H13Cl2NO/c1-3-7(2)11(15)14-8-4-5-9(12)10(13)6-8/h4-7H,3H2,1-2H3,(H,14,15)
InChIKey GREVJEWXSUUOOV-UHFFFAOYSA-N
Molecular Weight 246.137 g/mol
SMILES C1(Cl)=C(C=CC(=C1)NC(=O)C(CC)C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.862511