| SpectraBase Compound ID | 6jcujyuBpY |
|---|---|
| InChI | InChI=1S/C16H18O6/c1-20-14(17)11-10(9-7-5-4-6-8-9)12(15(18)21-2)13(11)16(19)22-3/h4-8,10-13H,1-3H3 |
| InChIKey | SFQQERMWOWPVLI-UHFFFAOYSA-N |
| Mol Weight | 306.31 g/mol |
| Molecular Formula | C16H18O6 |
| Exact Mass | 306.110338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6fK8LpfSFdg |
|---|---|
| Name | Trimethyl C-4-phenyl-R-1,T-2,T-3-cyclobutanetricarboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.110338294 u |
| Formula | C16H18O6 |
| InChI | InChI=1S/C16H18O6/c1-20-14(17)11-10(9-7-5-4-6-8-9)12(15(18)21-2)13(11)16(19)22-3/h4-8,10-13H,1-3H3 |
| InChIKey | SFQQERMWOWPVLI-UHFFFAOYSA-N |
| SMILES | C1(C(C(=O)OC)C(C1C(=O)OC)C=1C=CC=CC1)C(=O)OC |