| SpectraBase Spectrum ID |
4IIzTXW8QB3 |
| Name |
1,4-benzenedicarboxylic acid, 2-[[[4-(phenylmethyl)-1-piperazinyl]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 |
427.156577467 u |
| Formula |
C22H25N3O4S |
| InChI |
InChI=1S/C22H25N3O4S/c1-28-20(26)17-8-9-18(21(27)29-2)19(14-17)23-22(30)25-12-10-24(11-13-25)15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3,(H,23,30) |
| InChIKey |
HNIASLQSYZLBTQ-UHFFFAOYSA-N |
| Molecular Weight |
427.519 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_1008 |
| Solvent |
CDCl3 |
| Source |
Vendor ID: NMR/13239592 |
![1,4-benzenedicarboxylic acid, 2-[[[4-(phenylmethyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester](/api/spectrum/4IIzTXW8QB3/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[[4-(phenylmethyl)-1-piperazinyl]carbonothioyl]amino]-, dimethyl ester")
