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4'-Nitro-5-hydroxy-3-trifluoromethyl-biphenyl-4-carboxylic acid methyl ester
SpectraBase Compound ID GlGXbSMPBKX
InChI InChI=1S/C15H10F3NO5/c1-24-14(21)13-11(15(16,17)18)6-9(7-12(13)20)8-2-4-10(5-3-8)19(22)23/h2-7,20H,1H3
InChIKey PWXZPOKDWYGNKK-UHFFFAOYSA-N
Mol Weight 341.24 g/mol
Molecular Formula C15H10F3NO5
Exact Mass 341.051107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2r1Db6YcFb8
Name 4'-Nitro-5-hydroxy-3-trifluoromethyl-biphenyl-4-carboxylic acid methyl ester
Alternate Name(s) Methyl 2-hydroxy-4-(4-nitrophenyl)-6-(trifluoromethyl)benzoate Methyl 4-(4-nitrophenyl)-2-oxidanyl-6-(trifluoromethyl)benzoate
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Formula C15H10F3NO5
InChI InChI=1S/C15H10F3NO5/c1-24-14(21)13-11(15(16,17)18)6-9(7-12(13)20)8-2-4-10(5-3-8)19(22)23/h2-7,20H,1H3
InChIKey PWXZPOKDWYGNKK-UHFFFAOYSA-N
Molecular Weight 341.242 g/mol
SMILES Oc1c(c(C(F)(F)F)cc(c1)-c1ccc(N(=O)=O)cc1)C(=O)OC
SPLASH splash10-0a4i-0029000000-fb0e619fcd2d2e2b5174
Source of Spectrum F-65-2131-5w
Wiley ID 1681719