| SpectraBase Compound ID | G4cRoCGeopm |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-2-3-10(12(14)15)8-9-4-6-11(13)7-5-9/h2,4-7,10,13H,1,3,8H2,(H,14,15) |
| InChIKey | MQCKUPAXCBYOQY-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 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 | 6FvqkK9CwM1 |
|---|---|
| Name | Pent-4-enoic acid, 2-(4-hydroxybenzyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.094294308 u |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-2-3-10(12(14)15)8-9-4-6-11(13)7-5-9/h2,4-7,10,13H,1,3,8H2,(H,14,15) |
| InChIKey | MQCKUPAXCBYOQY-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C1=CC(=CC=C1O)CC(CC=C)C(O)=O |