| SpectraBase Compound ID | 48mjmCP7uJR |
|---|---|
| InChI | InChI=1S/C18H12N2O4/c19-11-13-1-5-15(6-2-13)23-17(21)9-10-18(22)24-16-7-3-14(12-20)4-8-16/h1-8H,9-10H2 |
| InChIKey | ZSXZIPXJWLPCKL-UHFFFAOYSA-N |
| Mol Weight | 320.3 g/mol |
| Molecular Formula | C18H12N2O4 |
| Exact Mass | 320.079707 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 | 3MHCqVhohE8 |
|---|---|
| Name | Succinic acid, di(4-cyanophenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.079706870 u |
| Formula | C18H12N2O4 |
| InChI | InChI=1S/C18H12N2O4/c19-11-13-1-5-15(6-2-13)23-17(21)9-10-18(22)24-16-7-3-14(12-20)4-8-16/h1-8H,9-10H2 |
| InChIKey | ZSXZIPXJWLPCKL-UHFFFAOYSA-N |
| Molecular Weight | 320.304 g/mol |
| SMILES | C(CCC(=O)OC1=CC=C(C#N)C=C1)(=O)OC1=CC=C(C#N)C=C1 |