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Glycine, N-(2-trifluoromethylbenzoyl)-, isohexyl ester
SpectraBase Compound ID 9IXWm5Ala4Q
InChI InChI=1S/C16H20F3NO3/c1-11(2)6-5-9-23-14(21)10-20-15(22)12-7-3-4-8-13(12)16(17,18)19/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,20,22)
InChIKey JCBDYQOQEXDJQS-UHFFFAOYSA-N
Mol Weight 331.34 g/mol
Molecular Formula C16H20F3NO3
Exact Mass 331.139528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BhSmOfdERu
Name Glycine, N-(2-trifluoromethylbenzoyl)-, isohexyl ester
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Formula C16H20F3NO3
InChI InChI=1S/C16H20F3NO3/c1-11(2)6-5-9-23-14(21)10-20-15(22)12-7-3-4-8-13(12)16(17,18)19/h3-4,7-8,11H,5-6,9-10H2,1-2H3,(H,20,22)
InChIKey JCBDYQOQEXDJQS-UHFFFAOYSA-N
Molecular Weight 331.335 g/mol
SMILES N(C(c1c(cccc1)C(F)(F)F)=O)CC(OCCCC(C)C)=O
SPLASH splash10-00di-1930000000-eeb9ba47096c73f276ca
Source of Spectrum NP-11-7914-0
Synonyms 2-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]acetic acid 4-methylpentyl ester 4-Methylpentyl 2-[[2-(trifluoromethyl)benzoyl]amino]acetate isohexyl 2-[[2-(trifluoromethyl)benzoyl]amino]acetate 4-Methylpentyl 2-[[2-(trifluoromethyl)phenyl]carbonylamino]ethanoate
Wiley ID 1109875