![2-[(E)-1-(2-phenylsulfanylphenyl)ethylideneamino]oxyacetic acid](/api/spectrum/67KbfFrdJSt/structure.png?h=300&w=458 "2-[(E)-1-(2-phenylsulfanylphenyl)ethylideneamino]oxyacetic acid")
| SpectraBase Compound ID | G2dCSZ9nkzE |
|---|---|
| InChI | InChI=1S/C16H15NO3S/c1-12(17-20-11-16(18)19)14-9-5-6-10-15(14)21-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,18,19)/b17-12+ |
| InChIKey | QSFCTITYLFDIPX-SFQUDFHCSA-N |
| Mol Weight | 301.36 g/mol |
| Molecular Formula | C16H15NO3S |
| Exact Mass | 301.077265 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 67KbfFrdJSt |
|---|---|
| Name | 2-[(E)-1-(2-Phenylsulfanylphenyl)ethylideneamino]oxyacetic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.077264518 u |
| Formula | C16H15NO3S |
| InChI | InChI=1S/C16H15NO3S/c1-12(17-20-11-16(18)19)14-9-5-6-10-15(14)21-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,18,19)/b17-12+ |
| InChIKey | QSFCTITYLFDIPX-SFQUDFHCSA-N |
| SMILES | C=1(C(SC=2C=CC=CC2)=CC=CC1)\C(=N\OCC(=O)O)C |