| SpectraBase Compound ID | 7qsM6Z2gnUy |
|---|---|
| InChI | InChI=1S/C16H14O4/c1-12(18)20-16-9-14(10-17)7-8-15(16)19-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | KQZHDJDYBSJBTA-UHFFFAOYSA-N |
| Mol Weight | 270.28 g/mol |
| Molecular Formula | C16H14O4 |
| Exact Mass | 270.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6g3MNhaMDAc |
|---|---|
| Name | Benzaldehyde, 3-(acetyloxy)-4-(phenylmethoxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.089208927 u |
| Formula | C16H14O4 |
| InChI | InChI=1S/C16H14O4/c1-12(18)20-16-9-14(10-17)7-8-15(16)19-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey | KQZHDJDYBSJBTA-UHFFFAOYSA-N |
| SMILES | C=1(OC(=O)C)C(OCC=2C=CC=CC2)=CC=C(C1)C=O |