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2-(5-Carboxy-n-pentyl)-3,5-dimethylphenol
SpectraBase Compound ID 9XT1wUlwach
InChI InChI=1S/C14H20O3/c1-10-8-11(2)12(13(15)9-10)6-4-3-5-7-14(16)17/h8-9,15H,3-7H2,1-2H3,(H,16,17)
InChIKey VAPRVNQUQRUKDM-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCaHAsvgfkT
Name 2-(5-Carboxy-n-pentyl)-3,5-dimethylphenol
Alternate Name(s) 6-(2-hydroxy-4,6-dimethylphenyl)hexanoic acid 6-(2,4-dimethyl-6-oxidanyl-phenyl)hexanoic acid
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Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-10-8-11(2)12(13(15)9-10)6-4-3-5-7-14(16)17/h8-9,15H,3-7H2,1-2H3,(H,16,17)
InChIKey VAPRVNQUQRUKDM-UHFFFAOYSA-N
Molecular Weight 236.311 g/mol
SMILES OC(CCCCCc1c(cc(cc1C)C)O)=O
SPLASH splash10-000i-0910000000-a59f4fb44da6accb42d2
Source of Spectrum JX-2015-6-8759
Wiley ID 1730050