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2'-hydroxy-3'-isopropyl-5'-methylpropiophenone
SpectraBase Compound ID 8lgEgSVquk3
InChI InChI=1S/C13H18O2/c1-5-12(14)11-7-9(4)6-10(8(2)3)13(11)15/h6-8,15H,5H2,1-4H3
InChIKey ZGMWNLUXUSIGEI-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 HpQGhZdNvxi
Name 1-Propanone, 1-[2-hydroxy-5-methyl-3-(1-methylethyl)phenyl]-
CAS Registry Number 129375-04-8
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-5-12(14)11-7-9(4)6-10(8(2)3)13(11)15/h6-8,15H,5H2,1-4H3
InChIKey ZGMWNLUXUSIGEI-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES Oc1c(C(=O)CC)cc(cc1C(C)C)C
SPLASH splash10-004i-0930000000-f0ae0d3364ec00750e5a
Source of Spectrum AH-121-235-14
Synonyms 1-(2-hydroxy-3-isopropyl-5-methylphenyl)-1-propanone 1-[2-hydroxy-5-methyl-3-(1-methylethyl)phenyl]-1-propanone 1-(2-hydroxy-5-methyl-3-propan-2-ylphenyl)-1-propanone 1-(2-hydroxy-5-methyl-3-propan-2-ylphenyl)propan-1-one 1-(5-methyl-2-oxidanyl-3-propan-2-yl-phenyl)propan-1-one
Wiley ID 1204782