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(2E,4E)-1-phenyl-5-(p-tolyl)penta-2,4-dien-1-one

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

(2E,4E)-1-phenyl-5-(p-tolyl)penta-2,4-dien-1-one
SpectraBase Compound ID DKjNDV0Pdnr
InChI InChI=1S/C18H16O/c1-15-11-13-16(14-12-15)7-5-6-10-18(19)17-8-3-2-4-9-17/h2-14H,1H3/b7-5+,10-6+
InChIKey BTAFHUXPKBPDCB-YLNKAEQOSA-N
Mol Weight 248.32 g/mol
Molecular Formula C18H16O
Exact Mass 248.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DSfJUogFBLP
Name (2E,4E)-1-Phenyl-5-(p-tolyl)penta-2,4-dien-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.120115134 u
Formula C18H16O
InChI InChI=1S/C18H16O/c1-15-11-13-16(14-12-15)7-5-6-10-18(19)17-8-3-2-4-9-17/h2-14H,1H3/b7-5+,10-6+
InChIKey BTAFHUXPKBPDCB-YLNKAEQOSA-N
Molecular Weight 248.325 g/mol
SMILES C(\C=C\C=C\C=1C=CC(=CC1)C)(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.885938