| SpectraBase Spectrum ID |
4bWk9yqF0L5 |
| Name |
benzoic acid, 4-[(4Z)-4,5-dihydro-3-methyl-4-[(5-methyl-2-thienyl)methylene]-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl 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 |
368.119463683 u |
| Formula |
C20H20N2O3S |
| InChI |
InChI=1S/C20H20N2O3S/c1-12(2)25-20(24)15-6-8-16(9-7-15)22-19(23)18(14(4)21-22)11-17-10-5-13(3)26-17/h5-12H,1-4H3/b18-11- |
| InChIKey |
ZOKFYMAIXSRMIX-WQRHYEAKSA-N |
| Molecular Weight |
368.451 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11580 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10271112; Lab Info: LP; Lab Number: LP-0340265 |
| Temperature |
23.85 °C |
![benzoic acid, 4-[(4Z)-4,5-dihydro-3-methyl-4-[(5-methyl-2-thienyl)methylene]-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester](/api/spectrum/4bWk9yqF0L5/structure.png?h=300&w=458 "benzoic acid, 4-[(4Z)-4,5-dihydro-3-methyl-4-[(5-methyl-2-thienyl)methylene]-5-oxo-1H-pyrazol-1-yl]-, 1-methylethyl ester")
