| SpectraBase Compound ID | 3NspZAjHWu9 |
|---|---|
| InChI | InChI=1S/C16H16O4/c1-11-8-13(9-14(17)15(11)16(18)19-2)20-10-12-6-4-3-5-7-12/h3-9,17H,10H2,1-2H3 |
| InChIKey | CNRWLRGPBCJARF-UHFFFAOYSA-N |
| Mol Weight | 272.3 g/mol |
| Molecular Formula | C16H16O4 |
| Exact Mass | 272.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HVOb87NTy8e |
|---|---|
| Name | 2-Hydroxy-6-methyl-4-phenylmethoxybenzoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.104858991 u |
| Formula | C16H16O4 |
| InChI | InChI=1S/C16H16O4/c1-11-8-13(9-14(17)15(11)16(18)19-2)20-10-12-6-4-3-5-7-12/h3-9,17H,10H2,1-2H3 |
| InChIKey | CNRWLRGPBCJARF-UHFFFAOYSA-N |
| Molecular Weight | 272.300 g/mol |
| SMILES | C=1(C(=CC(=CC1C)OCC1=CC=CC=C1)O)C(=O)OC |