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2',4'-Dihydroxy-3'-methylacetophenone
SpectraBase Compound ID 2wjuefJEqao
InChI InChI=1S/C9H10O3/c1-5-8(11)4-3-7(6(2)10)9(5)12/h3-4,11-12H,1-2H3
InChIKey KMTLZBUHQPQFAV-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C9H10O3
Exact Mass 166.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FEdFGD2YBFm
Name Ethanone, 1-(2,4-dihydroxy-3-methylphenyl)-
Alternate Name(s) 1-(2,4-Dihydroxy-3-methylphenyl)ethanone 1-[3-methyl-2,4-bis(oxidanyl)phenyl]ethanone 2',4'-Dihydroxy-3'-methylacetophenone
CAS Registry Number 10139-84-1
Comments Less than 3 mono-isotopic peaks
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Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-5-8(11)4-3-7(6(2)10)9(5)12/h3-4,11-12H,1-2H3
InChIKey KMTLZBUHQPQFAV-UHFFFAOYSA-N
Molecular Weight 166.176 g/mol
SMILES Oc1c(ccc(c1C)O)C(C)=O
SPLASH splash10-03di-0900000000-5160c83dd5010044f0ad
Source of Spectrum C5-2002-1860-6
Wiley ID 1614955