| SpectraBase Spectrum ID |
9ISIhRWuhkj |
| Name |
benzoic acid, 2-fluoro-, 3-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl 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 |
422.139033267 u |
| Formula |
C22H19FN4O4 |
| InChI |
InChI=1S/C22H19FN4O4/c1-11-17(20(28)26-24-11)19(18-12(2)25-27-21(18)29)13-6-5-7-14(10-13)31-22(30)15-8-3-4-9-16(15)23/h3-10,19H,1-2H3,(H2,24,26,28)(H2,25,27,29) |
| InChIKey |
ZBYPHMXRUCVJTM-UHFFFAOYSA-N |
| Molecular Weight |
422.416 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11593 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10271134; Lab Info: LP; Lab Number: LP-0900792 |
![benzoic acid, 2-fluoro-, 3-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl ester](/api/spectrum/9ISIhRWuhkj/structure.png?h=300&w=458 "benzoic acid, 2-fluoro-, 3-[bis(5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]phenyl ester")
