| SpectraBase Compound ID | DNJvP3YU5VB |
|---|---|
| InChI | InChI=1S/C17H18O4/c1-12(2)20-15-9-4-5-10-16(15)21-17(18)13-7-6-8-14(11-13)19-3/h4-12H,1-3H3 |
| InChIKey | CDBFQNMZHJGSBJ-UHFFFAOYSA-N |
| Mol Weight | 286.33 g/mol |
| Molecular Formula | C17H18O4 |
| Exact Mass | 286.120509 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FTLXRuRC79a |
|---|---|
| Name | m-Methoxybenzoic acid, 2-isopropoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.120509056 u |
| Formula | C17H18O4 |
| InChI | InChI=1S/C17H18O4/c1-12(2)20-15-9-4-5-10-16(15)21-17(18)13-7-6-8-14(11-13)19-3/h4-12H,1-3H3 |
| InChIKey | CDBFQNMZHJGSBJ-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC(=C1)OC)C(OC1=CC=CC=C1OC(C)C)=O |