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5,6,8-Tris[(trifluoromethanesulfonyl)oxy]-1,4-naphthoquinone
SpectraBase Compound ID ANvfVIFdO7m
InChI InChI=1S/C13H3F9O11S3/c14-11(15,16)34(25,26)31-6-3-7(32-35(27,28)12(17,18)19)10(33-36(29,30)13(20,21)22)9-5(24)2-1-4(23)8(6)9/h1-3H
InChIKey FWRKSGNCRIJQHM-UHFFFAOYSA-N
Mol Weight 602.32 g/mol
Molecular Formula C13H3F9O11S3
Exact Mass 601.869378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XBrB1GKiO
Name 5,6,8-Tris[(trifluoromethanesulfonyl)oxy]-1,4-naphthoquinone
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Formula C13H3F9O11S3
InChI InChI=1S/C13H3F9O11S3/c14-11(15,16)34(25,26)31-6-3-7(32-35(27,28)12(17,18)19)10(33-36(29,30)13(20,21)22)9-5(24)2-1-4(23)8(6)9/h1-3H
InChIKey FWRKSGNCRIJQHM-UHFFFAOYSA-N
Molecular Weight 602.322 g/mol
SMILES c1(OS(C(F)(F)F)(=O)=O)c2c(C(=O)C=CC2=O)c(cc1OS(C(F)(F)F)(=O)=O)OS(C(F)(F)F)(=O)=O
SPLASH splash10-0udl-0059006000-002c74f34bf3cfd4fc05
Source of Spectrum J-62-4527-14
Synonyms 5,8-Dioxo-2,4-bis{[(trifluoromethyl)sulfonyl]oxy}-5,8-dihydro-1-naphthalenyl trifluoromethanesulfonate Trifluoromethanesulfonic acid [5,8-dioxo-3,4-bis(trifluoromethylsulfonyloxy)-1-naphthalenyl] ester [5,8-dioxo-3,4-bis(trifluoromethylsulfonyloxy)naphthalen-1-yl] trifluoromethanesulfonate [5,8-dioxo-3,4-bis(trifluoromethylsulfonyloxy)-1-naphthyl] trifluoromethanesulfonate [5,8-bis(oxidanylidene)-3,4-bis(trifluoromethylsulfonyloxy)naphthalen-1-yl] tris(fluoranyl)methanesulfonate
Wiley ID 1410249