SpectraBase Spectrum ID |
2DIAKMaqrrB |
Name |
3,5-Dimethyl-2-phenylimino-1,3-thiazolidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
206.087769633 u |
Formula |
C11H14N2S |
InChI |
InChI=1S/C11H14N2S/c1-9-8-13(2)11(14-9)12-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b12-11+ |
InChIKey |
CBDNUKLTUMGNER-VAWYXSNFSA-N |
Molecular Weight |
206.307 g/mol |
SMILES |
C1(\N=C\2SC(CN2C)C)=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944535 |