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2,6-Dimethyl-4'-methoxythiocarbanilide

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

2,6-Dimethyl-4'-methoxythiocarbanilide
SpectraBase Compound ID EywfV6ALExi
InChI InChI=1S/C18H22N2OS/c1-4-13-7-6-8-14(5-2)17(13)20-18(22)19-15-9-11-16(21-3)12-10-15/h6-12H,4-5H2,1-3H3,(H2,19,20,22)
InChIKey ZWEYLXIKFSHFJP-UHFFFAOYSA-N
Mol Weight 314.45 g/mol
Molecular Formula C18H22N2OS
Exact Mass 314.145285 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KPPssiowkDf
Name 2,6-Dimethyl-4'-methoxythiocarbanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.145284509 u
Formula C18H22N2OS
InChI InChI=1S/C18H22N2OS/c1-4-13-7-6-8-14(5-2)17(13)20-18(22)19-15-9-11-16(21-3)12-10-15/h6-12H,4-5H2,1-3H3,(H2,19,20,22)
InChIKey ZWEYLXIKFSHFJP-UHFFFAOYSA-N
SMILES N(C1=CC=C(C=C1)OC)C(NC=1C(=CC=CC1CC)CC)=S
Spectrum/Structure Validation Score (Raman) 0.860254