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2,4,6-Trimethylmandelic acid
SpectraBase Compound ID FNvDqzEwdgu
InChI InChI=1S/C11H14O3/c1-6-4-7(2)9(8(3)5-6)10(12)11(13)14/h4-5,10,12H,1-3H3,(H,13,14)
InChIKey IRQXVXUXARGLQG-UHFFFAOYSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9psUeJpPKy
Name
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Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-6-4-7(2)9(8(3)5-6)10(12)11(13)14/h4-5,10,12H,1-3H3,(H,13,14)
InChIKey IRQXVXUXARGLQG-UHFFFAOYSA-N
Molecular Weight 194.0939
SMILES OC(C(O)=O)c1c(C)cc(C)cc1C
SPLASH splash10-0002-5900000000-bc86c290eb4394f74b9d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany