![1,1-Dimethyl-2-[(3',4'-dimethylphenoxy)carbonyl]ethane](/api/spectrum/7usboH2X2YN/structure.png?h=300&w=458 "1,1-Dimethyl-2-[(3',4'-dimethylphenoxy)carbonyl]ethane")
| SpectraBase Compound ID | GDmJ2utSU64 |
|---|---|
| InChI | InChI=1S/C13H18O2/c1-9(2)7-13(14)15-12-6-5-10(3)11(4)8-12/h5-6,8-9H,7H2,1-4H3 |
| InChIKey | TWQMCSXQLIHLIT-UHFFFAOYSA-N |
| Mol Weight | 206.28 g/mol |
| Molecular Formula | C13H18O2 |
| Exact Mass | 206.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7usboH2X2YN |
|---|---|
| Name | 1,1-Dimethyl-2-[(3',4'-dimethylphenoxy)carbonyl]ethane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.130679818 u |
| Formula | C13H18O2 |
| InChI | InChI=1S/C13H18O2/c1-9(2)7-13(14)15-12-6-5-10(3)11(4)8-12/h5-6,8-9H,7H2,1-4H3 |
| InChIKey | TWQMCSXQLIHLIT-UHFFFAOYSA-N |
| Molecular Weight | 206.285 g/mol |
| SMILES | C(OC=1C=C(C)C(=CC1)C)(=O)CC(C)C |