| SpectraBase Compound ID | GD4nTXPDIiP |
|---|---|
| InChI | InChI=1S/C17H16O4/c1-11(17(20)21-2)13-4-3-5-14(10-13)16(19)12-6-8-15(18)9-7-12/h3-11,18H,1-2H3 |
| InChIKey | HUEPRCAJXIOEHP-UHFFFAOYSA-N |
| Mol Weight | 284.31 g/mol |
| Molecular Formula | C17H16O4 |
| Exact Mass | 284.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gp1jq9Cpkdf |
|---|---|
| Name | 2-(3-(4-Hydroxybenzoyl)phenyl)propionicacid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.104858991 u |
| Formula | C17H16O4 |
| InChI | InChI=1S/C17H16O4/c1-11(17(20)21-2)13-4-3-5-14(10-13)16(19)12-6-8-15(18)9-7-12/h3-11,18H,1-2H3 |
| InChIKey | HUEPRCAJXIOEHP-UHFFFAOYSA-N |
| SMILES | C(C(C)C1=CC(=CC=C1)C(C1=CC=C(C=C1)O)=O)(=O)OC |