| SpectraBase Spectrum ID |
KlX8YVMAW9I |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[(2-hydroxyethyl)(phenylmethyl)amino]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 |
402.124942985 u |
| Formula |
C20H22N2O5S |
| InChI |
InChI=1S/C20H22N2O5S/c1-26-18(24)15-8-9-16(19(25)27-2)17(12-15)21-20(28)22(10-11-23)13-14-6-4-3-5-7-14/h3-9,12,23H,10-11,13H2,1-2H3,(H,21,28) |
| InChIKey |
VQEFJMJRRJRBRQ-UHFFFAOYSA-N |
| Molecular Weight |
402.465 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1355 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13248539 |
![1,4-benzenedicarboxylic acid, 2-[[[(2-hydroxyethyl)(phenylmethyl)amino]carbonothioyl]amino]-, dimethyl ester](/api/spectrum/KlX8YVMAW9I/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[(2-hydroxyethyl)(phenylmethyl)amino]carbonothioyl]amino]-, dimethyl ester")
