| SpectraBase Compound ID | EvbinbFCrT8 |
|---|---|
| InChI | InChI=1S/C22H20O4/c23-21(24)19(17-13-7-8-14-17)20(22(25)26)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,23,24)(H,25,26) |
| InChIKey | OXPDMUZWEMQLCN-UHFFFAOYSA-N |
| Mol Weight | 348.4 g/mol |
| Molecular Formula | C22H20O4 |
| Exact Mass | 348.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8AcnahraVp8 |
|---|---|
| Name | 2-Cyclopentylidene-3-(diphenylmethylene)succinic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.136159120 u |
| Formula | C22H20O4 |
| InChI | InChI=1S/C22H20O4/c23-21(24)19(17-13-7-8-14-17)20(22(25)26)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,23,24)(H,25,26) |
| InChIKey | OXPDMUZWEMQLCN-UHFFFAOYSA-N |
| SMILES | OC(C(C(C(O)=O)=C1CCCC1)=C(C1=CC=CC=C1)C=1C=CC=CC1)=O |