| SpectraBase Spectrum ID |
8npG4LXba1t |
| Name |
3,4-Dihydro-4-[(phenylsulfonyl)acetyl]-2H-1,4-benzothiazine, 1,1-dioxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
365.039164930 u |
| Formula |
C16H15NO5S2 |
| InChI |
InChI=1S/C16H15NO5S2/c18-16(12-24(21,22)13-6-2-1-3-7-13)17-10-11-23(19,20)15-9-5-4-8-14(15)17/h1-9H,10-12H2 |
| InChIKey |
FMNWIHKPYZWWNR-UHFFFAOYSA-N |
| Molecular Weight |
365.418 g/mol |
| SMILES |
C=1C(=CC=CC1)S(CC(=O)N1C=2C=CC=CC2S(CC1)(=O)=O)(=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.863533 |
![3,4-Dihydro-4-[(phenylsulfonyl)acetyl]-2H-1,4-benzothiazine, 1,1-dioxide](/api/spectrum/8npG4LXba1t/structure.png?h=300&w=458 "3,4-Dihydro-4-[(phenylsulfonyl)acetyl]-2H-1,4-benzothiazine, 1,1-dioxide")
