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1-(5-Methyl-2-p-toluoyl-phenyl)ethanone

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

1-(5-Methyl-2-p-toluoyl-phenyl)ethanone
SpectraBase Compound ID XThuoAbWIx
InChI InChI=1S/C17H16O2/c1-11-4-7-14(8-5-11)17(19)15-9-6-12(2)10-16(15)13(3)18/h4-10H,1-3H3
InChIKey CUJVJIHKTUKTSK-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J03fCV6tKWu
Name 1-(5-Methyl-2-p-toluoyl-phenyl)ethanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.115029753 u
Formula C17H16O2
InChI InChI=1S/C17H16O2/c1-11-4-7-14(8-5-11)17(19)15-9-6-12(2)10-16(15)13(3)18/h4-10H,1-3H3
InChIKey CUJVJIHKTUKTSK-UHFFFAOYSA-N
Molecular Weight 252.313 g/mol
SMILES C=1(C(C(=O)C)=CC(=CC1)C)C(C1=CC=C(C=C1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953959