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Benzoic acid, 4,4'-azobis[2,3,5,6-tetrafluoro-, dimethyl ester
SpectraBase Compound ID 8jhM5KTV4aQ
InChI InChI=1S/C16H6F8N2O4/c1-29-15(27)3-5(17)9(21)13(10(22)6(3)18)25-26-14-11(23)7(19)4(16(28)30-2)8(20)12(14)24/h1-2H3/b26-25+
InChIKey CCXWTEZCJIKKGW-OCEACIFDSA-N
Mol Weight 442.22 g/mol
Molecular Formula C16H6F8N2O4
Exact Mass 442.019982 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4elvnkxaag
Name Benzoic acid, 4,4'-azobis[2,3,5,6-tetrafluoro-, dimethyl ester
CAS Registry Number 126695-78-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H6F8N2O4
InChI InChI=1S/C16H6F8N2O4/c1-29-15(27)3-5(17)9(21)13(10(22)6(3)18)25-26-14-11(23)7(19)4(16(28)30-2)8(20)12(14)24/h1-2H3/b26-25+
InChIKey CCXWTEZCJIKKGW-OCEACIFDSA-N
Molecular Weight 442.221 g/mol
SMILES c1(c(c(F)c(c(c1F)F)C(=O)OC)F)\N=N\c1c(c(F)c(c(c1F)F)C(=O)OC)F
SPLASH splash10-0a74-0690400000-338995f3930968900104
Source of Spectrum J-55-3647-37
Synonyms Methyl 2,3,5,6-tetrafluoro-4-{(E)-[2,3,5,6-tetrafluoro-4-(methoxycarbonyl)phenyl]diazenyl}benzoate Methyl 4-((4-methoxycarbonyl-2,3,5,6-tetrafluorophenyl)azo)-2,3,5,6-tetrafluorobenzoate
Wiley ID 1385174