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N-(4-Chlorophenyl)-N-pentanoylpentanamide

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

N-(4-Chlorophenyl)-N-pentanoylpentanamide
SpectraBase Compound ID JUxMAQs45ix
InChI InChI=1S/C16H22ClNO2/c1-3-5-7-15(19)18(16(20)8-6-4-2)14-11-9-13(17)10-12-14/h9-12H,3-8H2,1-2H3
InChIKey OCHMSGBPCIHXFF-UHFFFAOYSA-N
Mol Weight 295.81 g/mol
Molecular Formula C16H22ClNO2
Exact Mass 295.133907 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KfsBOSOnMoS
Name N-(4-Chlorophenyl)-N-pentanoylpentanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.133906650 u
Formula C16H22ClNO2
InChI InChI=1S/C16H22ClNO2/c1-3-5-7-15(19)18(16(20)8-6-4-2)14-11-9-13(17)10-12-14/h9-12H,3-8H2,1-2H3
InChIKey OCHMSGBPCIHXFF-UHFFFAOYSA-N
Molecular Weight 295.810 g/mol
SMILES C1(N(C(CCCC)=O)C(CCCC)=O)=CC=C(C=C1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.875788