| SpectraBase Spectrum ID |
2e3BOTICKtw |
| Name |
benzo[b]thiophene-3-carboxylic acid, 2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-4,5,6,7-tetrahydro-, methyl 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 |
398.025868954 u |
| Formula |
C17H16Cl2N2O3S |
| InChI |
InChI=1S/C17H16Cl2N2O3S/c1-24-16(22)14-10-4-2-3-5-13(10)25-15(14)21-17(23)20-9-6-7-11(18)12(19)8-9/h6-8H,2-5H2,1H3,(H2,20,21,23) |
| InChIKey |
QIDKETOIHQJRKY-UHFFFAOYSA-N |
| Molecular Weight |
399.292 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_5334 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9290908; Lab Info: AU; Lab Number: AU-EC00884 |
![benzo[b]thiophene-3-carboxylic acid, 2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester](/api/spectrum/2e3BOTICKtw/structure.png?h=300&w=458 "benzo[b]thiophene-3-carboxylic acid, 2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester")
