SpectraBase Spectrum ID |
HPtUiQAYAcC |
Name |
5H-Thiazolo[2,3-B]quinazolin-5-one, 2,9-dimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
230.051384123 u |
Formula |
C12H10N2OS |
InChI |
InChI=1S/C12H10N2OS/c1-7-4-3-5-9-10(7)13-12-14(11(9)15)6-8(2)16-12/h3-6H,1-2H3 |
InChIKey |
FYHXCENWOYUBHN-UHFFFAOYSA-N |
Molecular Weight |
230.285 g/mol |
SMILES |
C1(N2C(=NC=3C(=CC=CC13)C)SC(=C2)C)=O |
Spectrum/Structure Validation Score (Raman) |
0.712161 |