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1-Pentanone, 4-methyl-1-(4-methylphenyl)-

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

1-Pentanone, 4-methyl-1-(4-methylphenyl)-
SpectraBase Compound ID FIm5dFXHHCO
InChI InChI=1S/C13H18O/c1-10(2)4-9-13(14)12-7-5-11(3)6-8-12/h5-8,10H,4,9H2,1-3H3
InChIKey PPEFLCWGGLBAGA-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GFEExHgA3e
Name 1-Pentanone, 4-methyl-1-(4-methylphenyl)-
CAS Registry Number 21847-98-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-10(2)4-9-13(14)12-7-5-11(3)6-8-12/h5-8,10H,4,9H2,1-3H3
InChIKey PPEFLCWGGLBAGA-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C(c1ccc(cc1)C)(=O)CCC(C)C
SPLASH splash10-015c-1900000000-1cc284740502f85aa907
Source of Spectrum B-40-1029-9
Synonyms 4-Methyl-1-(4-methylphenyl)-1-pentanone 4-Methyl-1-(4-methylphenyl)pentan-1-one 4-Methyl-1-(p-tolyl)pentan-1-one
Wiley ID 1187049