| SpectraBase Compound ID | EDrcuUpRQ8u |
|---|---|
| InChI | InChI=1S/C17H13NO3/c1-10-2-7-13-14(17(20)21)9-15(18-16(13)8-10)11-3-5-12(19)6-4-11/h2-9,19H,1H3,(H,20,21) |
| InChIKey | DDMFGLSJOBHDLQ-UHFFFAOYSA-N |
| Mol Weight | 279.29 g/mol |
| Molecular Formula | C17H13NO3 |
| Exact Mass | 279.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JhTLCJN3Pxf |
|---|---|
| Name | 4'-Hydroxy-7-methylcinchophenic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.089543280 u |
| Formula | C17H13NO3 |
| InChI | InChI=1S/C17H13NO3/c1-10-2-7-13-14(17(20)21)9-15(18-16(13)8-10)11-3-5-12(19)6-4-11/h2-9,19H,1H3,(H,20,21) |
| InChIKey | DDMFGLSJOBHDLQ-UHFFFAOYSA-N |
| Molecular Weight | 279.295 g/mol |
| SMILES | C(O)(C1=CC(=NC2=CC(C)=CC=C12)C1=CC=C(C=C1)O)=O |