For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-(2-Amino-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-phenylpropanoic acid
SpectraBase Compound ID 5jmIaH88Six
InChI InChI=1S/C18H16FN3O2/c19-13-8-6-12(7-9-13)16-17(22-18(20)21-16)14(10-15(23)24)11-4-2-1-3-5-11/h1-9,14H,10H2,(H,23,24)(H3,20,21,22)
InChIKey IBEABJQXHXCJCL-UHFFFAOYSA-N
Mol Weight 325.34 g/mol
Molecular Formula C18H16FN3O2
Exact Mass 325.122655 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5iKzDkjUkc0
Name 3-(2-Amino-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-phenylpropanoic acid
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16FN3O2
InChI InChI=1S/C18H16FN3O2/c19-13-8-6-12(7-9-13)16-17(22-18(20)21-16)14(10-15(23)24)11-4-2-1-3-5-11/h1-9,14H,10H2,(H,23,24)(H3,20,21,22)
InChIKey IBEABJQXHXCJCL-UHFFFAOYSA-N
Instrument Name Varian 1200L
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.101
Molecular Weight 325.343 g/mol
SMILES [nH]1c(c(nc1N)-c1ccc(cc1)F)C(c1ccccc1)CC(O)=O
SPLASH splash10-03di-9152000000-21d28c70d61c765f43f2
Source of Spectrum BJO-15-SM22-11f
Wiley ID 1845848