| SpectraBase Spectrum ID |
84e2YlIKq8p |
| Name |
benzoic acid, 4-[1,4-dihydro-6-methyl-1-(2-methylphenyl)-4-oxo-5H-pyrazolo[3,4-d]pyrimidin-5-yl]-, ethyl ester |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.153540517 u |
| Formula |
C22H20N4O3 |
| InChI |
InChI=1S/C22H20N4O3/c1-4-29-22(28)16-9-11-17(12-10-16)25-15(3)24-20-18(21(25)27)13-23-26(20)19-8-6-5-7-14(19)2/h5-13H,4H2,1-3H3 |
| InChIKey |
PLPVVXSOQRVYJQ-UHFFFAOYSA-N |
| Molecular Weight |
388.427 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_2295 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13268569 |
![benzoic acid, 4-[1,4-dihydro-6-methyl-1-(2-methylphenyl)-4-oxo-5H-pyrazolo[3,4-d]pyrimidin-5-yl]-, ethyl ester](/api/spectrum/84e2YlIKq8p/structure.png?h=300&w=458 "benzoic acid, 4-[1,4-dihydro-6-methyl-1-(2-methylphenyl)-4-oxo-5H-pyrazolo[3,4-d]pyrimidin-5-yl]-, ethyl ester")
