| SpectraBase Compound ID | 7d3FPEJVCiO |
|---|---|
| InChI | InChI=1S/C14H18O4/c1-3-10-17-13(15)8-9-14(16)18-12-7-5-4-6-11(12)2/h4-7H,3,8-10H2,1-2H3 |
| InChIKey | VBUOIDUNQIPNTH-UHFFFAOYSA-N |
| Mol Weight | 250.29 g/mol |
| Molecular Formula | C14H18O4 |
| Exact Mass | 250.120509 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 | Nv3wVnFG6q |
|---|---|
| Name | Succinic acid, 2-methylphenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.120509056 u |
| Formula | C14H18O4 |
| InChI | InChI=1S/C14H18O4/c1-3-10-17-13(15)8-9-14(16)18-12-7-5-4-6-11(12)2/h4-7H,3,8-10H2,1-2H3 |
| InChIKey | VBUOIDUNQIPNTH-UHFFFAOYSA-N |
| Molecular Weight | 250.294 g/mol |
| SMILES | C(OC1=C(C=CC=C1)C)(=O)CCC(OCCC)=O |