| SpectraBase Compound ID | LYUpxZyTwef |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-2-9-15-12(14)8-7-10-5-3-4-6-11(10)13/h3-6,13H,2,7-9H2,1H3 |
| InChIKey | WOQCBCOZVWYLKS-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5HIytRzljSF |
|---|---|
| Name | Propyl 3-(2-hydroxyphenyl)propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.109944372 u |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-2-9-15-12(14)8-7-10-5-3-4-6-11(10)13/h3-6,13H,2,7-9H2,1H3 |
| InChIKey | WOQCBCOZVWYLKS-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C1(=C(C=CC=C1)O)CCC(=O)OCCC |