SpectraBase Spectrum ID |
KDoz6iPjZDM |
Name |
N-[5-oxo-3-(2,6-Xylyl)-2-thiazolidinylidene]-p-anisamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
354.103813619 u |
Formula |
C19H18N2O3S |
InChI |
InChI=1S/C19H18N2O3S/c1-12-5-4-6-13(2)17(12)21-11-16(22)25-19(21)20-18(23)14-7-9-15(24-3)10-8-14/h4-10H,11H2,1-3H3/b20-19- |
InChIKey |
IMMIHJOXJXTLTD-VXPUYCOJSA-N |
Molecular Weight |
354.424 g/mol |
SMILES |
C=1C(=CC=C(C1)OC)C(\N=C/1SC(CN1C=1C(=CC=CC1C)C)=O)=O |
Spectrum/Structure Validation Score (Raman) |
0.895459 |