| SpectraBase Compound ID | GT0QSV2D8Ik |
|---|---|
| InChI | InChI=1S/C17H18O2/c1-13-7-6-8-14(2)17(13)19-16(18)12-11-15-9-4-3-5-10-15/h3-10H,11-12H2,1-2H3 |
| InChIKey | RQZMSLJUNHKDIC-UHFFFAOYSA-N |
| Mol Weight | 254.33 g/mol |
| Molecular Formula | C17H18O2 |
| Exact Mass | 254.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Byo2xa8WyD8 |
|---|---|
| Name | 2,6-Dimethylphenyl .beta.-phenylpropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.130679818 u |
| Formula | C17H18O2 |
| InChI | InChI=1S/C17H18O2/c1-13-7-6-8-14(2)17(13)19-16(18)12-11-15-9-4-3-5-10-15/h3-10H,11-12H2,1-2H3 |
| InChIKey | RQZMSLJUNHKDIC-UHFFFAOYSA-N |
| Molecular Weight | 254.329 g/mol |
| SMILES | C(C(OC=1C(C)=CC=CC1C)=O)CC=1C=CC=CC1 |