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N-butyl-3'-chlorocarbanilide
SpectraBase Compound ID Ld0S669BP1I
InChI InChI=1S/C17H19ClN2O/c1-2-3-12-20(16-10-5-4-6-11-16)17(21)19-15-9-7-8-14(18)13-15/h4-11,13H,2-3,12H2,1H3,(H,19,21)
InChIKey KBSAXRYDENBBJM-UHFFFAOYSA-N
Mol Weight 302.81 g/mol
Molecular Formula C17H19ClN2O
Exact Mass 302.118591 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3ljyVu91S41
Name N-Butyl-3'-chlorocarbanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.118590939 u
Formula C17H19ClN2O
InChI InChI=1S/C17H19ClN2O/c1-2-3-12-20(16-10-5-4-6-11-16)17(21)19-15-9-7-8-14(18)13-15/h4-11,13H,2-3,12H2,1H3,(H,19,21)
InChIKey KBSAXRYDENBBJM-UHFFFAOYSA-N
SMILES N(C1=CC=CC(=C1)Cl)C(N(C=1C=CC=CC1)CCCC)=O
Spectrum/Structure Validation Score (Raman) 0.834499