![Methyl 5'-methyl-2'-(acetoxymethyl)-[1,1'-biphenyl]-4-carboxylate](/api/spectrum/IE64CixHk3N/structure.png?h=300&w=458 "Methyl 5'-methyl-2'-(acetoxymethyl)-[1,1'-biphenyl]-4-carboxylate")
| SpectraBase Compound ID | 7axu7yPWwkQ |
|---|---|
| InChI | InChI=1S/C18H18O4/c1-12-4-5-16(11-22-13(2)19)17(10-12)14-6-8-15(9-7-14)18(20)21-3/h4-10H,11H2,1-3H3 |
| InChIKey | FKGODPKCASBURF-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C18H18O4 |
| Exact Mass | 298.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IE64CixHk3N |
|---|---|
| Name | Methyl 5'-methyl-2'-(acetoxymethyl)-[1,1'-biphenyl]-4-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.120509056 u |
| Formula | C18H18O4 |
| InChI | InChI=1S/C18H18O4/c1-12-4-5-16(11-22-13(2)19)17(10-12)14-6-8-15(9-7-14)18(20)21-3/h4-10H,11H2,1-3H3 |
| InChIKey | FKGODPKCASBURF-UHFFFAOYSA-N |
| SMILES | C1=CC(=CC(=C1COC(=O)C)C=1C=CC(=CC1)C(OC)=O)C |