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3-(2,5-dimethylphenyl)-3-methyl-2-butanone
SpectraBase Compound ID HPIe88oKSBb
InChI InChI=1S/C13H18O/c1-9-6-7-10(2)12(8-9)13(4,5)11(3)14/h6-8H,1-5H3
InChIKey AXRPOKRJJXKYCW-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 GQHUtkcRCnL
Name 3-(2,5-dimethylphenyl)-3-methyl-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-9-6-7-10(2)12(8-9)13(4,5)11(3)14/h6-8H,1-5H3
InChIKey AXRPOKRJJXKYCW-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES c1(C(C(=O)C)(C)C)c(ccc(c1)C)C
SPLASH splash10-016v-1900000000-92bee58c6a2759036a29
Source of Spectrum F-47-9122-3
Synonyms 3-(2,5-dimethylphenyl)-3-methylbutan-2-one
Wiley ID 1187061