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3-Benzyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid
SpectraBase Compound ID ENLAQhtzuFA
InChI InChI=1S/C18H16F3NO4/c19-18(20,21)26-15-8-6-14(7-9-15)22-17(25)13(11-16(23)24)10-12-4-2-1-3-5-12/h1-9,13H,10-11H2,(H,22,25)(H,23,24)
InChIKey CSKGFBGBSIVICU-UHFFFAOYSA-N
Mol Weight 367.32 g/mol
Molecular Formula C18H16F3NO4
Exact Mass 367.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LnHKNVLQx6s
Name 3-Benzyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid
Alternate Name(s) 3-Benzyl-4-keto-4-[4-(trifluoromethoxy)anilino]butyric acid 4-Oxidanylidene-3-(phenylmethyl)-4-[[4-(trifluoromethyloxy)phenyl]amino]butanoic acid 4-Oxo-3-(phenylmethyl)-4-[4-(trifluoromethoxy)anilino]butanoic acid
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Formula C18H16F3NO4
InChI InChI=1S/C18H16F3NO4/c19-18(20,21)26-15-8-6-14(7-9-15)22-17(25)13(11-16(23)24)10-12-4-2-1-3-5-12/h1-9,13H,10-11H2,(H,22,25)(H,23,24)
InChIKey CSKGFBGBSIVICU-UHFFFAOYSA-N
Molecular Weight 367.324 g/mol
SMILES N(C(C(CC(O)=O)Cc1ccccc1)=O)c1ccc(cc1)OC(F)(F)F
SPLASH splash10-016r-7940000000-8378c083d6aac3ff8c9f
Wiley ID 1445171