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4-[(E)-2-(4-tert-butylsulfanylphenyl)vinyl]benzaldehyde

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

4-[(E)-2-(4-tert-butylsulfanylphenyl)vinyl]benzaldehyde
SpectraBase Compound ID 6DEut3SxUtp
InChI InChI=1S/C19H20OS/c1-19(2,3)21-18-12-10-16(11-13-18)5-4-15-6-8-17(14-20)9-7-15/h4-14H,1-3H3/b5-4+
InChIKey PKGKCHGTLKXXMF-SNAWJCMRSA-N
Mol Weight 296.43 g/mol
Molecular Formula C19H20OS
Exact Mass 296.123486 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CsXQCtfXlcR
Name 4-[(E)-2-(4-Tert-butylsulfanylphenyl)vinyl]benzaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.123486437 u
Formula C19H20OS
InChI InChI=1S/C19H20OS/c1-19(2,3)21-18-12-10-16(11-13-18)5-4-15-6-8-17(14-20)9-7-15/h4-14H,1-3H3/b5-4+
InChIKey PKGKCHGTLKXXMF-SNAWJCMRSA-N
SMILES C=1(\C=C\C2=CC=C(C=O)C=C2)C=CC(SC(C)(C)C)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.890384