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3-Bromo-benzoic acid [1-(2-fluoro-benzyl)-1H-benzoimidazol-2-yl]-phenyl-methyl ester
SpectraBase Compound ID FG4wS513Hli
InChI InChI=1S/C28H20BrFN2O2/c29-22-13-8-12-20(17-22)28(33)34-26(19-9-2-1-3-10-19)27-31-24-15-6-7-16-25(24)32(27)18-21-11-4-5-14-23(21)30/h1-17,26H,18H2
InChIKey ASSVQBXVSZPKOK-UHFFFAOYSA-N
Mol Weight 515.38 g/mol
Molecular Formula C28H20BrFN2O2
Exact Mass 514.069219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JyeaLxsHrK1
Name 3-Bromo-benzoic acid [1-(2-fluoro-benzyl)-1H-benzoimidazol-2-yl]-phenyl-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20BrFN2O2
InChI InChI=1S/C28H20BrFN2O2/c29-22-13-8-12-20(17-22)28(33)34-26(19-9-2-1-3-10-19)27-31-24-15-6-7-16-25(24)32(27)18-21-11-4-5-14-23(21)30/h1-17,26H,18H2
InChIKey ASSVQBXVSZPKOK-UHFFFAOYSA-N
Molecular Weight 515.382 g/mol
SMILES c1([n](c2ccccc2n1)Cc1c(F)cccc1)C(OC(c1cc(Br)ccc1)=O)c1ccccc1
SPLASH splash10-0a59-2936000000-7d99dcf440d85573f743
Synonyms [1-(2-fluorobenzyl)-1H-benzimidazol-2-yl](phenyl)methyl 3-bromobenzoate
Wiley ID 1455140