| SpectraBase Compound ID | HaGRBq8Qfjm |
|---|---|
| InChI | InChI=1S/C14H12N2O2/c1-10-5-2-3-8-13(10)16-15-12-7-4-6-11(9-12)14(17)18/h2-9H,1H3,(H,17,18)/b16-15+ |
| InChIKey | GTVMQZCITUXHIS-FOCLMDBBSA-N |
| Mol Weight | 240.26 g/mol |
| Molecular Formula | C14H12N2O2 |
| Exact Mass | 240.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47smGfOIsYH |
|---|---|
| Name | 2'-Methylazobenzene-3-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.089877632 u |
| Formula | C14H12N2O2 |
| InChI | InChI=1S/C14H12N2O2/c1-10-5-2-3-8-13(10)16-15-12-7-4-6-11(9-12)14(17)18/h2-9H,1H3,(H,17,18)/b16-15+ |
| InChIKey | GTVMQZCITUXHIS-FOCLMDBBSA-N |
| Molecular Weight | 240.262 g/mol |
| SMILES | C1(=C(\N=N\C2=CC=CC(=C2)C(=O)O)C=CC=C1)C |