SpectraBase Spectrum ID |
DnRDl4QxbTp |
Name |
benzoic acid, 2-[[[7-(chlorodifluoromethyl)-5-(2-thienyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl]amino]-, 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 |
462.036495492 u |
Formula |
C20H13ClF2N4O3S |
InChI |
InChI=1S/C20H13ClF2N4O3S/c1-30-19(29)11-5-2-3-6-12(11)25-18(28)14-10-17-24-13(15-7-4-8-31-15)9-16(20(21,22)23)27(17)26-14/h2-10H,1H3,(H,25,28) |
InChIKey |
HKEOBIWSALDRTA-UHFFFAOYSA-N |
Molecular Weight |
462.859 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_18283 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11250898; Lab Info: DAL; Lab Number: DAL-idk0403 |