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p-tert-butyl-N-(3-chloropropyl)benzamide

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

p-tert-butyl-N-(3-chloropropyl)benzamide
SpectraBase Compound ID Kq6VjhRW38h
InChI InChI=1S/C14H20ClNO/c1-14(2,3)12-7-5-11(6-8-12)13(17)16-10-4-9-15/h5-8H,4,9-10H2,1-3H3,(H,16,17)
InChIKey QTSGFIBFSWGTPI-UHFFFAOYSA-N
Mol Weight 253.77 g/mol
Molecular Formula C14H20ClNO
Exact Mass 253.123342 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 12lWvTJjckO
Name p-Tert-butyl-N-(3-chloropropyl)benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.123341967 u
Formula C14H20ClNO
InChI InChI=1S/C14H20ClNO/c1-14(2,3)12-7-5-11(6-8-12)13(17)16-10-4-9-15/h5-8H,4,9-10H2,1-3H3,(H,16,17)
InChIKey QTSGFIBFSWGTPI-UHFFFAOYSA-N
Molecular Weight 253.773 g/mol
SMILES N(C(C1=CC=C(C=C1)C(C)(C)C)=O)CCCCl
Spectrum/Structure Validation Score (Raman) 0.978854