| SpectraBase Spectrum ID |
L9yROzcX8Mu |
| Name |
2H-1,4-Benzothiazin-2-one, 3-[2-(4-methylphenyl)-2-oxoethyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.066699835 u |
| Formula |
C17H13NO2S |
| InChI |
InChI=1S/C17H13NO2S/c1-11-6-8-12(9-7-11)15(19)10-14-17(20)21-16-5-3-2-4-13(16)18-14/h2-9H,10H2,1H3 |
| InChIKey |
HSRVQSYJGHVDID-UHFFFAOYSA-N |
| Molecular Weight |
295.356 g/mol |
| SMILES |
C1=CC=C2N=C(C(=O)SC2=C1)CC(C=1C=CC(C)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910369 |
![2H-1,4-Benzothiazin-2-one, 3-[2-(4-methylphenyl)-2-oxoethyl]-](/api/spectrum/L9yROzcX8Mu/structure.png?h=300&w=458 "2H-1,4-Benzothiazin-2-one, 3-[2-(4-methylphenyl)-2-oxoethyl]-")
