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Butanamide, 4-chloro-N-(2'-benzoylphenyl)-
SpectraBase Compound ID 6sh17ctsa9n
InChI InChI=1S/C17H16ClNO2/c18-12-6-11-16(20)19-15-10-5-4-9-14(15)17(21)13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2,(H,19,20)
InChIKey NBHYKLRJVPLFFC-UHFFFAOYSA-N
Mol Weight 301.77 g/mol
Molecular Formula C17H16ClNO2
Exact Mass 301.086956 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8U59qPbzEv
Name Butanamide, 4-chloro-N-(2'-benzoylphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.086956457 u
Formula C17H16ClNO2
InChI InChI=1S/C17H16ClNO2/c18-12-6-11-16(20)19-15-10-5-4-9-14(15)17(21)13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2,(H,19,20)
InChIKey NBHYKLRJVPLFFC-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)NC(=O)CCCCl)C(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970887