SpectraBase Spectrum ID |
F0XI1sOBRfr |
Name |
3-[(1,1-dioxido-1,2-benzisothiazol-3-yl)amino]propyl 4-(1-piperidinylsulfonyl)benzoate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
491.118477879 u |
Formula |
C22H25N3O6S2 |
InChI |
InChI=1S/C22H25N3O6S2/c26-22(17-9-11-18(12-10-17)33(29,30)25-14-4-1-5-15-25)31-16-6-13-23-21-19-7-2-3-8-20(19)32(27,28)24-21/h2-3,7-12H,1,4-6,13-16H2,(H,23,24) |
InChIKey |
ZPWRIFCKSDUVBC-UHFFFAOYSA-N |
Molecular Weight |
491.577 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_4028 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12308650 |