| SpectraBase Spectrum ID |
3c5hHWSMEUl |
| Name |
8-Methyl-12H-benzothiazolo[2,3-B]quinazoline-12-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.051384123 u |
| Formula |
C15H10N2OS |
| InChI |
InChI=1S/C15H10N2OS/c1-9-6-7-12-13(8-9)19-15-16-11-5-3-2-4-10(11)14(18)17(12)15/h2-8H,1H3 |
| InChIKey |
DEBIGNGXZOWYHV-UHFFFAOYSA-N |
| SMILES |
C1=2N(C(C3=C(N2)C=CC=C3)=O)C=2C(S1)=CC(=CC2)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828535 |
![8-Methyl-12H-benzothiazolo[2,3-b]quinazoline-12-one](/api/spectrum/3c5hHWSMEUl/structure.png?h=300&w=458 "8-Methyl-12H-benzothiazolo[2,3-b]quinazoline-12-one")
