![p-{[(dimethylamino)methylene]amino}benzoic acid, ethyl ester](/api/spectrum/IP0VKtHQHqK/structure.png?h=300&w=458 "p-{[(dimethylamino)methylene]amino}benzoic acid, ethyl ester")
| SpectraBase Compound ID | KrhQzNigEHx |
|---|---|
| InChI | InChI=1S/C12H16N2O2/c1-4-16-12(15)10-5-7-11(8-6-10)13-9-14(2)3/h5-9H,4H2,1-3H3/b13-9+ |
| InChIKey | GHHKNAGPUBEDLN-UKTHLTGXSA-N |
| Mol Weight | 220.27 g/mol |
| Molecular Formula | C12H16N2O2 |
| Exact Mass | 220.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IP0VKtHQHqK |
|---|---|
| Name | p-{[(dimethylamino)methylene]amino}benzoic acid, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.121177761 u |
| Formula | C12H16N2O2 |
| InChI | InChI=1S/C12H16N2O2/c1-4-16-12(15)10-5-7-11(8-6-10)13-9-14(2)3/h5-9H,4H2,1-3H3/b13-9+ |
| InChIKey | GHHKNAGPUBEDLN-UKTHLTGXSA-N |
| Molecular Weight | 220.272 g/mol |
| SMILES | C=1C(=CC=C(C1)\N=C\N(C)C)C(OCC)=O |