SpectraBase Spectrum ID |
9YrUWlL2GyU |
Name |
1,3-benzenedicarboxylic acid, 5-[[[3-amino-4-(1-piperidinyl)phenyl]sulfonyl]amino]-, dimethyl 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 |
447.146406705 u |
Formula |
C21H25N3O6S |
InChI |
InChI=1S/C21H25N3O6S/c1-29-20(25)14-10-15(21(26)30-2)12-16(11-14)23-31(27,28)17-6-7-19(18(22)13-17)24-8-4-3-5-9-24/h6-7,10-13,23H,3-5,8-9,22H2,1-2H3 |
InChIKey |
WSFHDSNUVGSWKD-UHFFFAOYSA-N |
Molecular Weight |
447.506 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_9410 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9069450; Lab Info: KWN; Lab Number: KWN-0003536 |