SpectraBase Spectrum ID |
ElYEyXRicYD |
Name |
3-thiophenecarboxylic acid, 2-[(3,4-dichlorobenzoyl)amino]-5-[[(2-fluorophenyl)amino]carbonyl]-4-methyl-, ethyl 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 |
494.027011768 u |
Formula |
C22H17Cl2FN2O4S |
InChI |
InChI=1S/C22H17Cl2FN2O4S/c1-3-31-22(30)17-11(2)18(20(29)26-16-7-5-4-6-15(16)25)32-21(17)27-19(28)12-8-9-13(23)14(24)10-12/h4-10H,3H2,1-2H3,(H,26,29)(H,27,28) |
InChIKey |
DXBVQLURLQJABB-UHFFFAOYSA-N |
Molecular Weight |
495.352 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8194 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9253281; Lab Info: SAS; Lab Number: SAS-TST1533 |
Temperature |
29.85 °C |