| SpectraBase Compound ID | 3u0AC8gFW5w |
|---|---|
| InChI | InChI=1S/C22H20O2/c1-17-11-9-10-16-20(17)22(21(23)24-2,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h3-16H,1-2H3 |
| InChIKey | WEUHKYUKMCDIFJ-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C22H20O2 |
| Exact Mass | 316.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E3lfqLtViPS |
|---|---|
| Name | Methyl diphenyl-o-tolylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.146329882 u |
| Formula | C22H20O2 |
| InChI | InChI=1S/C22H20O2/c1-17-11-9-10-16-20(17)22(21(23)24-2,18-12-5-3-6-13-18)19-14-7-4-8-15-19/h3-16H,1-2H3 |
| InChIKey | WEUHKYUKMCDIFJ-UHFFFAOYSA-N |
| Molecular Weight | 316.400 g/mol |
| SMILES | C1(=CC=CC=C1C(C=1C=CC=CC1)(C=1C=CC=CC1)C(OC)=O)C |