![4-[(E)-2-(4-methylphenyl)ethenyl]benzaldehyde](/api/spectrum/LTy43lm1gF3/structure.png?h=300&w=458 "4-[(E)-2-(4-methylphenyl)ethenyl]benzaldehyde")
| SpectraBase Compound ID | CxhoYPQsKh3 |
|---|---|
| InChI | InChI=1S/C16H14O/c1-13-2-4-14(5-3-13)6-7-15-8-10-16(12-17)11-9-15/h2-12H,1H3/b7-6+ |
| InChIKey | KRODJIOXBRPBOT-VOTSOKGWSA-N |
| Mol Weight | 222.29 g/mol |
| Molecular Formula | C16H14O |
| Exact Mass | 222.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LTy43lm1gF3 |
|---|---|
| Name | 4-[(E)-2-(4-Methylphenyl)ethenyl]benzaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.104465070 u |
| Formula | C16H14O |
| InChI | InChI=1S/C16H14O/c1-13-2-4-14(5-3-13)6-7-15-8-10-16(12-17)11-9-15/h2-12H,1H3/b7-6+ |
| InChIKey | KRODJIOXBRPBOT-VOTSOKGWSA-N |
| Molecular Weight | 222.287 g/mol |
| SMILES | C=1(\C=C\C2=CC=C(C=O)C=C2)C=CC(=CC1)C |