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3-(2-Amino-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-(p-tolyl)propanoic acid
SpectraBase Compound ID EA83zns7Okz
InChI InChI=1S/C19H18FN3O2/c1-11-2-4-12(5-3-11)15(10-16(24)25)18-17(22-19(21)23-18)13-6-8-14(20)9-7-13/h2-9,15H,10H2,1H3,(H,24,25)(H3,21,22,23)
InChIKey VSSKXYCCYBFRDZ-UHFFFAOYSA-N
Mol Weight 339.37 g/mol
Molecular Formula C19H18FN3O2
Exact Mass 339.138305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnefFjMh1wA
Name 3-(2-Amino-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-(p-tolyl)propanoic acid
Appearance Pale yellow solid
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Formula C19H18FN3O2
InChI InChI=1S/C19H18FN3O2/c1-11-2-4-12(5-3-11)15(10-16(24)25)18-17(22-19(21)23-18)13-6-8-14(20)9-7-13/h2-9,15H,10H2,1H3,(H,24,25)(H3,21,22,23)
InChIKey VSSKXYCCYBFRDZ-UHFFFAOYSA-N
Instrument Name Varian 1200L
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.101
Molecular Weight 339.370 g/mol
SMILES [nH]1c(c(nc1N)-c1ccc(cc1)F)C(c1ccc(cc1)C)CC(O)=O
SPLASH splash10-03di-9273000000-be86dcf1af92054eefff
Source of Spectrum BJO-15-SM23-11g
Wiley ID 1845849