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2-Heptanone, 6-methyl-5-(3-methylphenyl)-
SpectraBase Compound ID CJYjmyUw9Mx
InChI InChI=1S/C15H22O/c1-11(2)15(9-8-13(4)16)14-7-5-6-12(3)10-14/h5-7,10-11,15H,8-9H2,1-4H3
InChIKey QXLOPTJHHYNTTF-UHFFFAOYSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CukLOBTHaqP
Name 2-Heptanone, 6-methyl-5-(3-methylphenyl)-
CAS Registry Number 88134-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-11(2)15(9-8-13(4)16)14-7-5-6-12(3)10-14/h5-7,10-11,15H,8-9H2,1-4H3
InChIKey QXLOPTJHHYNTTF-UHFFFAOYSA-N
Molecular Weight 218.340 g/mol
SMILES c1(C(CCC(=O)C)C(C)C)cc(C)ccc1
SPLASH splash10-0006-9700000000-a200cafac86b5f2ec2e5
Source of Spectrum H-66-1848-0
Synonyms 6-Methyl-5-(3-methylphenyl)-2-heptanone 6-Methyl-5-(3-methylphenyl)heptan-2-one
Wiley ID 1218152