| SpectraBase Spectrum ID |
7qwMFKdQb8A |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[2-(3-pyridinyl)-1-piperidinyl]carbonothioyl]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 |
413.140927403 u |
| Formula |
C21H23N3O4S |
| InChI |
InChI=1S/C21H23N3O4S/c1-27-19(25)14-8-9-16(20(26)28-2)17(12-14)23-21(29)24-11-4-3-7-18(24)15-6-5-10-22-13-15/h5-6,8-10,12-13,18H,3-4,7,11H2,1-2H3,(H,23,29) |
| InChIKey |
NPCMQVLCKHAVLK-UHFFFAOYSA-N |
| Molecular Weight |
413.492 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1013 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239597 |
![1,4-benzenedicarboxylic acid, 2-[[[2-(3-pyridinyl)-1-piperidinyl]carbonothioyl]amino]-, dimethyl ester](/api/spectrum/7qwMFKdQb8A/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[2-(3-pyridinyl)-1-piperidinyl]carbonothioyl]amino]-, dimethyl ester")
