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Thio-3,3',4-trimethoxycarbanilide

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

Thio-3,3',4-trimethoxycarbanilide
SpectraBase Compound ID D1spzU1oW1D
InChI InChI=1S/C16H18N2O3S/c1-19-13-6-4-5-11(9-13)17-16(22)18-12-7-8-14(20-2)15(10-12)21-3/h4-10H,1-3H3,(H2,17,18,22)
InChIKey DNWXRGYJCBRJBF-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C16H18N2O3S
Exact Mass 318.103814 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FoTJBC0JXqO
Name Thio-3,3',4-trimethoxycarbanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.103813619 u
Formula C16H18N2O3S
InChI InChI=1S/C16H18N2O3S/c1-19-13-6-4-5-11(9-13)17-16(22)18-12-7-8-14(20-2)15(10-12)21-3/h4-10H,1-3H3,(H2,17,18,22)
InChIKey DNWXRGYJCBRJBF-UHFFFAOYSA-N
SMILES N(C1=CC=CC(=C1)OC)C(NC=1C=CC(=C(OC)C1)OC)=S
Spectrum/Structure Validation Score (Raman) 0.940001