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3,3,3-Trifluoro-2-trifluoromethyl-propionic acid 5-(2-chloro-5-trifluoromethyl-phenoxy)-2-nitro-phenyl ester
SpectraBase Compound ID 34flSgFAWE7
InChI InChI=1S/C17H7ClF9NO5/c18-9-3-1-7(15(19,20)21)5-11(9)32-8-2-4-10(28(30)31)12(6-8)33-14(29)13(16(22,23)24)17(25,26)27/h1-6,13H
InChIKey BKBCMCNBMJBDMS-UHFFFAOYSA-N
Mol Weight 511.68 g/mol
Molecular Formula C17H7ClF9NO5
Exact Mass 510.986903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIONXA0u7je
Name 3,3,3-Trifluoro-2-trifluoromethyl-propionic acid 5-(2-chloro-5-trifluoromethyl-phenoxy)-2-nitro-phenyl ester
Alternate Name(s) 3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid[5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitrophenyl]ester [5-[2-chloranyl-5-(trifluoromethyl)phenoxy]-2-nitro-phenyl]3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate [5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitro-phenyl]3,3,3-trifluoro-2-(trifluoromethyl)propanoate 3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid [5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitrophenyl] ester [5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitrophenyl] 3,3,3-trifluoro-2-(trifluoromethyl)propanoate [5-[2-chloro-5-(trifluoromethyl)phenoxy]-2-nitro-phenyl] 3,3,3-trifluoro-2-(trifluoromethyl)propanoate [5-[2-chloranyl-5-(trifluoromethyl)phenoxy]-2-nitro-phenyl] 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate
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Formula C17H7ClF9NO5
InChI InChI=1S/C17H7ClF9NO5/c18-9-3-1-7(15(19,20)21)5-11(9)32-8-2-4-10(28(30)31)12(6-8)33-14(29)13(16(22,23)24)17(25,26)27/h1-6,13H
InChIKey BKBCMCNBMJBDMS-UHFFFAOYSA-N
Molecular Weight 511.684 g/mol
SMILES c1c(Oc2cc(C(F)(F)F)ccc2Cl)cc(c(N(=O)=O)c1)OC(C(C(F)(F)F)C(F)(F)F)=O
SPLASH splash10-0hgo-9321000000-ad611df898cc343e9453
Wiley ID 1443686