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4-(2-Chloro-3,4-dimethoxyphenyl)butanoic acid
SpectraBase Compound ID FKFOCXXMHhZ
InChI InChI=1S/C12H15ClO4/c1-16-9-7-6-8(4-3-5-10(14)15)11(13)12(9)17-2/h6-7H,3-5H2,1-2H3,(H,14,15)
InChIKey ZYPOYVGOPNVIHC-UHFFFAOYSA-N
Mol Weight 258.7 g/mol
Molecular Formula C12H15ClO4
Exact Mass 258.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kB3l66Udzc
Name 4-(2-Chloro-3,4-dimethoxyphenyl)butanoic acid
Alternate Name(s) 4-(2-Chloro-3,4-dimethoxy-phenyl)butanoic acid 4-(2-Chloranyl-3,4-dimethoxy-phenyl)butanoic acid
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Formula C12H15ClO4
InChI InChI=1S/C12H15ClO4/c1-16-9-7-6-8(4-3-5-10(14)15)11(13)12(9)17-2/h6-7H,3-5H2,1-2H3,(H,14,15)
InChIKey ZYPOYVGOPNVIHC-UHFFFAOYSA-N
Molecular Weight 258.701 g/mol
SMILES OC(CCCc1c(c(c(cc1)OC)OC)Cl)=O
SPLASH splash10-052r-0960000000-89d2b86b416f2eb19121
Source of Spectrum J-63-5914-20
Wiley ID 1261384