![3-Benzofuranone, 6-methoxy-2-[(1-methyl-1H-pyrazol-4-yl)methylidene]-](/api/spectrum/CCskewi4Sg2/structure.png?h=300&w=458 "3-Benzofuranone, 6-methoxy-2-[(1-methyl-1H-pyrazol-4-yl)methylidene]-")
| SpectraBase Compound ID | 4DlTZslp1fe |
|---|---|
| InChI | InChI=1S/C14H12N2O3/c1-16-8-9(7-15-16)5-13-14(17)11-4-3-10(18-2)6-12(11)19-13/h3-8H,1-2H3/b13-5- |
| InChIKey | OXNAJVXGWVKROF-ACAGNQJTSA-N |
| Mol Weight | 256.26 g/mol |
| Molecular Formula | C14H12N2O3 |
| Exact Mass | 256.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CCskewi4Sg2 |
|---|---|
| Name | 3-Benzofuranone, 6-methoxy-2-[(1-methyl-1H-pyrazol-4-yl)methylidene]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.084792251 u |
| Formula | C14H12N2O3 |
| InChI | InChI=1S/C14H12N2O3/c1-16-8-9(7-15-16)5-13-14(17)11-4-3-10(18-2)6-12(11)19-13/h3-8H,1-2H3/b13-5- |
| InChIKey | OXNAJVXGWVKROF-ACAGNQJTSA-N |
| Molecular Weight | 256.261 g/mol |
| SMILES | C12=CC(=CC=C2C(=O)\C(O1)=C\C1=CN(C)N=C1)OC |