SpectraBase Spectrum ID |
CRa6OsDCBmN |
Name |
Thiazoline, 3-methyl-2-thiobenzoylimino- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.028540678 u |
Formula |
C11H10N2S2 |
InChI |
InChI=1S/C11H10N2S2/c1-13-7-8-15-11(13)12-10(14)9-5-3-2-4-6-9/h2-8H,1H3/b12-11- |
InChIKey |
GPTLQXYTHWTLDN-QXMHVHEDSA-N |
Molecular Weight |
234.335 g/mol |
SMILES |
C1=CS\C(N1C)=N/C(=S)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974783 |