| SpectraBase Compound ID | LQu30G1GYlC |
|---|---|
| InChI | InChI=1S/C12H13NO4/c1-8(12(15)16)7-11(14)13-9-3-5-10(17-2)6-4-9/h3-6H,1,7H2,2H3,(H,13,14)(H,15,16) |
| InChIKey | CUUWBACGFVIQNQ-UHFFFAOYSA-N |
| Mol Weight | 235.24 g/mol |
| Molecular Formula | C12H13NO4 |
| Exact Mass | 235.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6UedOA1V5nk |
|---|---|
| Name | 4'-Methoxy-2-methylenesuccinanilic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.084457899 u |
| Formula | C12H13NO4 |
| InChI | InChI=1S/C12H13NO4/c1-8(12(15)16)7-11(14)13-9-3-5-10(17-2)6-4-9/h3-6H,1,7H2,2H3,(H,13,14)(H,15,16) |
| InChIKey | CUUWBACGFVIQNQ-UHFFFAOYSA-N |
| Molecular Weight | 235.239 g/mol |
| SMILES | N(C1=CC=C(C=C1)OC)C(CC(C(=O)O)=C)=O |