| SpectraBase Compound ID | 8HVQFFjplws |
|---|---|
| InChI | InChI=1S/C11H12N2O4/c1-6-7(2-3-10(14)15)8(4-11(16)17)9(5-12)13-6/h13H,2-4H2,1H3,(H,14,15)(H,16,17)/p-2 |
| InChIKey | VXHLQLCMKSIYEP-UHFFFAOYSA-L |
| Mol Weight | 234.21 g/mol |
| Molecular Formula | C11H10N2O4 |
| Exact Mass | 234.064057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUvkK7YBarA |
|---|---|
| Name | 5-CYANO-4-(CARBOXYMETHYL)-2-METHYL-PYRROLE-3-PROPANOIC-ACID |
| Compound Number | 13 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C11H12N2O4/c1-6-7(2-3-10(14)15)8(4-11(16)17)9(5-12)13-6/h13H,2-4H2,1H3,(H,14,15)(H,16,17)/p-2 |
| InChIKey | VXHLQLCMKSIYEP-UHFFFAOYSA-L |
| Literature Reference | F.J.LEEPER,M.ROCK,D.APPLETON J.CHEM.SOC.PERKIN-1,2633(1996) |
| Solvent | Deuterium oxide |
| Technique | APT, DEPT, INEPT |