| SpectraBase Spectrum ID |
DkhESZFItqi |
| Name |
4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
281.020333446 u |
| Formula |
C11H8ClN3O4 |
| InChI |
InChI=1S/C11H8ClN3O4/c12-9-6-14(13-10(9)15(18)19)5-7-1-3-8(4-2-7)11(16)17/h1-4,6H,5H2,(H,16,17) |
| InChIKey |
NDPOIGJDZZNZNU-UHFFFAOYSA-N |
| Molecular Weight |
281.655 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_9117 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13228361 |
![4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid](/api/spectrum/DkhESZFItqi/structure.png?h=300&w=458 "4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid")
