| SpectraBase Compound ID | C93elIstvld |
|---|---|
| InChI | InChI=1S/C14H12O/c1-11-2-6-13(7-3-11)14-8-4-12(10-15)5-9-14/h2-10H,1H3 |
| InChIKey | BCINBWXQYBLSKO-UHFFFAOYSA-N |
| Mol Weight | 196.25 g/mol |
| Molecular Formula | C14H12O |
| Exact Mass | 196.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HJ0iEwGCISJ |
|---|---|
| Name | 4-(4-Methylphenyl)benzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.088815005 u |
| Formula | C14H12O |
| InChI | InChI=1S/C14H12O/c1-11-2-6-13(7-3-11)14-8-4-12(10-15)5-9-14/h2-10H,1H3 |
| InChIKey | BCINBWXQYBLSKO-UHFFFAOYSA-N |
| Molecular Weight | 196.249 g/mol |
| SMILES | C(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898815 |