| SpectraBase Compound ID | LIsRVPMK6CS |
|---|---|
| InChI | InChI=1S/C12H14O5/c1-17-10-4-2-8(3-5-10)9(6-11(13)14)7-12(15)16/h2-5,9H,6-7H2,1H3,(H,13,14)(H,15,16) |
| InChIKey | LJLKATTUJLTMDE-UHFFFAOYSA-N |
| Mol Weight | 238.24 g/mol |
| Molecular Formula | C12H14O5 |
| Exact Mass | 238.084124 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 | 52ckrCr4S1J |
|---|---|
| Name | 3-(p-Methoxyphenyl)glutaric acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.084123546 u |
| Formula | C12H14O5 |
| InChI | InChI=1S/C12H14O5/c1-17-10-4-2-8(3-5-10)9(6-11(13)14)7-12(15)16/h2-5,9H,6-7H2,1H3,(H,13,14)(H,15,16) |
| InChIKey | LJLKATTUJLTMDE-UHFFFAOYSA-N |
| Molecular Weight | 238.239 g/mol |
| SMILES | OC(CC(CC(O)=O)C1=CC=C(C=C1)OC)=O |