| SpectraBase Compound ID | LcMHgLcsY7j |
|---|---|
| InChI | InChI=1S/C14H18O3/c1-12(2)13(3,4)17-14(12,11(15)16)10-8-6-5-7-9-10/h5-9H,1-4H3,(H,15,16) |
| InChIKey | WQSZLLRWOSYZGU-UHFFFAOYSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9KcmDHqvbKt |
|---|---|
| Name | 2-Oxetanecarboxylic acid, 3,3,4,4-tetramethyl-2-phenyl-, (.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c1-12(2)13(3,4)17-14(12,11(15)16)10-8-6-5-7-9-10/h5-9H,1-4H3,(H,15,16) |
| InChIKey | WQSZLLRWOSYZGU-UHFFFAOYSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | C1(C(C)(C)C(O1)(C)C)(C(=O)O)C=1C=CC=CC1 |