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4-[(E)-2-(4-methylphenyl)ethenyl]benzaldehyde

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

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

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GYhFhVxNSXr
Name 4-[(E)-2-(4-Methylphenyl)ethenyl]benzaldehyde
Comments Computed using SmartSpectra Model v1.42
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
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939884