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4-[(dimethylamino)methyl]benzoic acid
SpectraBase Compound ID FoFANtb8RSX
InChI InChI=1S/C10H13NO2/c1-11(2)7-8-3-5-9(6-4-8)10(12)13/h3-6H,7H2,1-2H3,(H,12,13)
InChIKey ABFSTRGQQNSRNH-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KW7pd5qtKrJ
Name 4-[(dimethylamino)methyl]benzoic acid
Alternate Name(s) 4-[(Dimethylammonio)methyl]benzoate 4-[(Dimethylazaniumyl)methyl]benzoate
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Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-11(2)7-8-3-5-9(6-4-8)10(12)13/h3-6H,7H2,1-2H3,(H,12,13)
InChIKey ABFSTRGQQNSRNH-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES OC(c1ccc(cc1)CN(C)C)=O
SPLASH splash10-0a4i-9400000000-68e3ae28b20784880fe3
Source of Spectrum G-55-1825-0
Wiley ID 748130