| SpectraBase Compound ID | D663naH32pA |
|---|---|
| InChI | InChI=1S/C9H8N2O3/c12-9(13)8-3-2-7(14-8)6-11-5-1-4-10-11/h1-5H,6H2,(H,12,13) |
| InChIKey | FZCNKLLKDQIBAZ-UHFFFAOYSA-N |
| Mol Weight | 192.17 g/mol |
| Molecular Formula | C9H8N2O3 |
| Exact Mass | 192.053492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3X6j7ekVym4 |
|---|---|
| Name | 5-(1H-Pyrazol-1-ylmethyl)-2-furoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.053492123 u |
| Formula | C9H8N2O3 |
| InChI | InChI=1S/C9H8N2O3/c12-9(13)8-3-2-7(14-8)6-11-5-1-4-10-11/h1-5H,6H2,(H,12,13) |
| InChIKey | FZCNKLLKDQIBAZ-UHFFFAOYSA-N |
| Molecular Weight | 192.174 g/mol |
| SMILES | OC(C=1OC(CN2N=CC=C2)=CC1)=O |