| SpectraBase Spectrum ID |
FardtrLj72X |
| Name |
4-[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)methyl]benzoic acid |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.035793627 u |
| Formula |
C15H11NO5S |
| InChI |
InChI=1S/C15H11NO5S/c17-14-12-3-1-2-4-13(12)22(20,21)16(14)9-10-5-7-11(8-6-10)15(18)19/h1-8H,9H2,(H,18,19) |
| InChIKey |
SZXYUCMJXHGNGH-UHFFFAOYSA-N |
| Molecular Weight |
317.315 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_7537 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12318923 |
![4-[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)methyl]benzoic acid](/api/spectrum/FardtrLj72X/structure.png?h=300&w=458 "4-[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)methyl]benzoic acid")
