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Methyl 4-[(1-benzyl-1H-benzimidazol-2-yl)amino]-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
SpectraBase Compound ID 2q9iHSP1WFS
InChI InChI=1S/C20H18F3N3O4/c1-30-17(28)19(29,20(21,22)23)11-16(27)25-18-24-14-9-5-6-10-15(14)26(18)12-13-7-3-2-4-8-13/h2-10,29H,11-12H2,1H3,(H,24,25,27)
InChIKey NOTFQGOMTJAYLK-UHFFFAOYSA-N
Mol Weight 421.38 g/mol
Molecular Formula C20H18F3N3O4
Exact Mass 421.124941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnAQUcr6YYB
Name Methyl 4-[(1-benzyl-1H-benzimidazol-2-yl)amino]-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18F3N3O4
InChI InChI=1S/C20H18F3N3O4/c1-30-17(28)19(29,20(21,22)23)11-16(27)25-18-24-14-9-5-6-10-15(14)26(18)12-13-7-3-2-4-8-13/h2-10,29H,11-12H2,1H3,(H,24,25,27)
InChIKey NOTFQGOMTJAYLK-UHFFFAOYSA-N
Molecular Weight 421.376 g/mol
SMILES OC(CC(=O)Nc1nc2c([n]1Cc1ccccc1)cccc2)(C(F)(F)F)C(OC)=O
SPLASH splash10-0006-9220000000-b2769ea383211448de93
Synonyms N-(1-benzyl-1H-benzoimidazol-2-yl)-2-hydroxy-2-trifluoromethyl-succinamic acid methyl ester
Wiley ID 1447956