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1-(4-Methylphenyl)-1-hexanone
SpectraBase Compound ID Kvi1Y1ghIZW
InChI InChI=1S/C13H18O/c1-3-4-5-6-13(14)12-9-7-11(2)8-10-12/h7-10H,3-6H2,1-2H3
InChIKey OGRXDZGVASXMGD-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 Btx9Tojpmqr
Name 1-(4-Methylphenyl)-1-hexanone
Alternate Name(s) 1-(p-tolyl)hexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-3-4-5-6-13(14)12-9-7-11(2)8-10-12/h7-10H,3-6H2,1-2H3
InChIKey OGRXDZGVASXMGD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cssc.201300815
Molecular Weight 190.286 g/mol
SMILES C(CCCCC)(=O)c1ccc(cc1)C
SPLASH splash10-015c-3900000000-4dc0d49941aece0f0d22
Source of Spectrum CSC-7-105/SM5-SM5_5
Wiley ID 1787394