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4-[(2-butyl-4-formyl-1-imidazolyl)methyl]benzoic acid methyl ester
SpectraBase Compound ID 2eE1piTvoNH
InChI InChI=1S/C17H20N2O3/c1-3-4-5-16-18-15(12-20)11-19(16)10-13-6-8-14(9-7-13)17(21)22-2/h6-9,11-12H,3-5,10H2,1-2H3
InChIKey YHKHBRKTWHGPMT-UHFFFAOYSA-N
Mol Weight 300.36 g/mol
Molecular Formula C17H20N2O3
Exact Mass 300.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjNcdzc3ETQ
Name 4-[(2-butyl-4-formyl-1-imidazolyl)methyl]benzoic acid methyl ester
Alternate Name(s) 4-[(2-butyl-4-formyl-imidazol-1-yl)methyl]benzoic acid methyl ester Methyl 4-[(2-butyl-4-formyl-imidazol-1-yl)methyl]benzoate Methyl 4-[(2-butyl-4-methanoyl-imidazol-1-yl)methyl]benzoate
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Formula C17H20N2O3
InChI InChI=1S/C17H20N2O3/c1-3-4-5-16-18-15(12-20)11-19(16)10-13-6-8-14(9-7-13)17(21)22-2/h6-9,11-12H,3-5,10H2,1-2H3
InChIKey YHKHBRKTWHGPMT-UHFFFAOYSA-N
Molecular Weight 300.358 g/mol
SMILES c1(nc(c[n]1Cc1ccc(cc1)C(=O)OC)C=O)CCCC
SPLASH splash10-052b-0941000000-7d67558fab8b8b3855a6
Source of Spectrum Y1-36-814-3
Wiley ID 1527160