| SpectraBase Compound ID | GMupWDcVFNc |
|---|---|
| InChI | InChI=1S/C13H16O5/c1-9(14)18-11-6-4-10(8-12(11)16-2)5-7-13(15)17-3/h4,6,8H,5,7H2,1-3H3 |
| InChIKey | MGOLGGITPZZLBR-UHFFFAOYSA-N |
| Mol Weight | 252.27 g/mol |
| Molecular Formula | C13H16O5 |
| Exact Mass | 252.099774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AkeXdXQ7ZYw |
|---|---|
| Name | ho-Methoxyhydrocinnamic acid meac P617 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.099773610 u |
| Formula | C13H16O5 |
| InChI | InChI=1S/C13H16O5/c1-9(14)18-11-6-4-10(8-12(11)16-2)5-7-13(15)17-3/h4,6,8H,5,7H2,1-3H3 |
| InChIKey | MGOLGGITPZZLBR-UHFFFAOYSA-N |
| Molecular Weight | 252.266 g/mol |
| SMILES | C=1(OC(=O)C)C(=CC(=CC1)CCC(=O)OC)OC |