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2',4'-dimethyl-6'-hydroxypropiophenone
SpectraBase Compound ID 9NQGLtyaa75
InChI InChI=1S/C11H14O2/c1-4-9(12)11-8(3)5-7(2)6-10(11)13/h5-6,13H,4H2,1-3H3
InChIKey BHKDPAPVRAFUKH-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8a5fYO0GoFt
Name 1-(2,4-dimethyl-6-oxidanyl-phenyl)propan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-4-9(12)11-8(3)5-7(2)6-10(11)13/h5-6,13H,4H2,1-3H3
InChIKey BHKDPAPVRAFUKH-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES Oc1c(c(cc(C)c1)C)C(=O)CC
SPLASH splash10-0002-0900000000-ecccf08b46d752c2959f
Source of Spectrum SO-0-27-14
Synonyms 1-(2-hydroxy-4,6-dimethyl-phenyl)propan-1-one 1-(2-hydroxy-4,6-dimethylphenyl)-1-propanone
Wiley ID 1540404