| SpectraBase Compound ID | CS0GvXZMM5f |
|---|---|
| InChI | InChI=1S/C14H10N2O2/c15-8-10-1-4-12(5-2-10)16-9-11-3-6-13(17)14(18)7-11/h1-7,9,17-18H/b16-9+ |
| InChIKey | WGKIYMJXPWIUEU-CXUHLZMHSA-N |
| Mol Weight | 238.25 g/mol |
| Molecular Formula | C14H10N2O2 |
| Exact Mass | 238.074228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ECReQPWnNJ |
|---|---|
| Name | Benzonitrile, 4-(3,4-dihydroxybenzylidenamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.074227568 u |
| Formula | C14H10N2O2 |
| InChI | InChI=1S/C14H10N2O2/c15-8-10-1-4-12(5-2-10)16-9-11-3-6-13(17)14(18)7-11/h1-7,9,17-18H/b16-9+ |
| InChIKey | WGKIYMJXPWIUEU-CXUHLZMHSA-N |
| Molecular Weight | 238.246 g/mol |
| SMILES | C1=CC(\N=C\C=2C=C(O)C(=CC2)O)=CC=C1C#N |