| SpectraBase Compound ID | E6sPvHv4VGJ |
|---|---|
| InChI | InChI=1S/C16H14O5/c1-11-6-8-12(9-7-11)15(17)20-13-4-3-5-14(10-13)21-16(18)19-2/h3-10H,1-2H3 |
| InChIKey | LPHHSYZWHYHAFA-UHFFFAOYSA-N |
| Mol Weight | 286.28 g/mol |
| Molecular Formula | C16H14O5 |
| Exact Mass | 286.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IcBpGGHAmzA |
|---|---|
| Name | 1,3-Benzenediol, o-methoxycarbonyl-o'-(4-methylbenzoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.084123546 u |
| Formula | C16H14O5 |
| InChI | InChI=1S/C16H14O5/c1-11-6-8-12(9-7-11)15(17)20-13-4-3-5-14(10-13)21-16(18)19-2/h3-10H,1-2H3 |
| InChIKey | LPHHSYZWHYHAFA-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC(=C1)OC(OC)=O)OC(C1=CC=C(C)C=C1)=O |