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2'-hydroxy-4'-isopropyl-6'-methylpropiophenone
SpectraBase Compound ID JiI54BKT7OQ
InChI InChI=1S/C13H18O2/c1-5-11(14)13-9(4)6-10(8(2)3)7-12(13)15/h6-8,15H,5H2,1-4H3
InChIKey ZPDJGIKJHIILLO-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56FhMMtCocT
Name 1-(2-hydroxy-4-isopropyl-6-methyl-phenyl)propan-1-one
Alternate Name(s) 1-(2-hydroxy-6-methyl-4-propan-2-ylphenyl)-1-propanone 1-(2-hydroxy-6-methyl-4-propan-2-ylphenyl)propan-1-one 1-(2-methyl-6-oxidanyl-4-propan-2-yl-phenyl)propan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-5-11(14)13-9(4)6-10(8(2)3)7-12(13)15/h6-8,15H,5H2,1-4H3
InChIKey ZPDJGIKJHIILLO-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES Oc1c(c(cc(C(C)C)c1)C)C(=O)CC
SPLASH splash10-004i-0920000000-b5863ce5d3e2e19a893f
Source of Spectrum SO-0-27-14
Wiley ID 1540403