SpectraBase Spectrum ID |
5yaQP5mMUC |
Name |
4,4'-Diethoxythiocarbanilide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
316.124549064 u |
Formula |
C17H20N2O2S |
InChI |
InChI=1S/C17H20N2O2S/c1-3-20-15-9-5-13(6-10-15)18-17(22)19-14-7-11-16(12-8-14)21-4-2/h5-12H,3-4H2,1-2H3,(H2,18,19,22) |
InChIKey |
PRXHANOJNVGVGC-UHFFFAOYSA-N |
Molecular Weight |
316.419 g/mol |
SMILES |
N(C1=CC=C(C=C1)OCC)C(NC=1C=CC(=CC1)OCC)=S |
Spectrum/Structure Validation Score (Raman) |
0.894059 |