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2-Penten-1-one, 2,4-dimethyl-1-phenyl-, (E)-

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

2-Penten-1-one, 2,4-dimethyl-1-phenyl-, (E)-
SpectraBase Compound ID 8hGQkAwRZ30
InChI InChI=1S/C13H16O/c1-10(2)9-11(3)13(14)12-7-5-4-6-8-12/h4-10H,1-3H3/b11-9+
InChIKey WENPPHPREGCTQJ-PKNBQFBNSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 64sy9yaHgaN
Name 2-Penten-1-one, 2,4-dimethyl-1-phenyl-, (E)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.120115134 u
Formula C13H16O
InChI InChI=1S/C13H16O/c1-10(2)9-11(3)13(14)12-7-5-4-6-8-12/h4-10H,1-3H3/b11-9+
InChIKey WENPPHPREGCTQJ-PKNBQFBNSA-N
Molecular Weight 188.270 g/mol
SMILES C(\C(=C\C(C)C)C)(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9762