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2-Chloropropanoyl amide, N-(2-phenylethyl)-N-pentyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Chloropropanoyl amide, N-(2-phenylethyl)-N-pentyl-
SpectraBase Compound ID CCJDiv8pGIq
InChI InChI=1S/C16H24ClNO/c1-3-4-8-12-18(16(19)14(2)17)13-11-15-9-6-5-7-10-15/h5-7,9-10,14H,3-4,8,11-13H2,1-2H3
InChIKey PGCNBGDJOPNULS-UHFFFAOYSA-N
Mol Weight 281.83 g/mol
Molecular Formula C16H24ClNO
Exact Mass 281.154642 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3Hzico2LBlY
Name 2-Chloropropanoyl amide, N-(2-phenylethyl)-N-pentyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.154642096 u
Formula C16H24ClNO
InChI InChI=1S/C16H24ClNO/c1-3-4-8-12-18(16(19)14(2)17)13-11-15-9-6-5-7-10-15/h5-7,9-10,14H,3-4,8,11-13H2,1-2H3
InChIKey PGCNBGDJOPNULS-UHFFFAOYSA-N
SMILES CC(Cl)C(=O)N(CCCCC)CCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944024