| SpectraBase Compound ID | 4VdgJqAoF2A |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-9-6-7-14-12(15-9)11-4-2-10(8-13)3-5-11/h2-5,8-9,12H,6-7H2,1H3 |
| InChIKey | UZLIKDGEMTXPMQ-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HPCJltb8qlN |
|---|---|
| Name | Benzaldehyde, 4-(4-methyl-1,3-dioxan-2-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.094294308 u |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-9-6-7-14-12(15-9)11-4-2-10(8-13)3-5-11/h2-5,8-9,12H,6-7H2,1H3 |
| InChIKey | UZLIKDGEMTXPMQ-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C1=C(C=CC(=C1)C1OC(C)CCO1)C=O |