| SpectraBase Spectrum ID |
7o4964Z7lZI |
| Name |
benzoic acid, 4-(1,1-dimethylethyl)-, 2-[(1,1-dioxido-1,2-benzisothiazol-3-yl)methylamino]ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.145678431 u |
| Formula |
C21H24N2O4S |
| InChI |
InChI=1S/C21H24N2O4S/c1-21(2,3)16-11-9-15(10-12-16)20(24)27-14-13-23(4)19-17-7-5-6-8-18(17)28(25,26)22-19/h5-12H,13-14H2,1-4H3 |
| InChIKey |
FCBQSFSLBGNUIH-UHFFFAOYSA-N |
| Molecular Weight |
400.493 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_305 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7043996; Lab Info: LP; Lab Number: LP-1900162 |
| Temperature |
29.85 °C |
![benzoic acid, 4-(1,1-dimethylethyl)-, 2-[(1,1-dioxido-1,2-benzisothiazol-3-yl)methylamino]ethyl ester](/api/spectrum/7o4964Z7lZI/structure.png?h=300&w=458 "benzoic acid, 4-(1,1-dimethylethyl)-, 2-[(1,1-dioxido-1,2-benzisothiazol-3-yl)methylamino]ethyl ester")
