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Methyl 3',4',5'-Trimethoxy-4-[2-(trifluoromethanesulfonyloxy)benzoyl]biphenyl-2-carboxylate
SpectraBase Compound ID IP1G1jhIOYN
InChI InChI=1S/C25H21F3O9S/c1-33-20-12-15(13-21(34-2)23(20)35-3)16-10-9-14(11-18(16)24(30)36-4)22(29)17-7-5-6-8-19(17)37-38(31,32)25(26,27)28/h5-13H,1-4H3
InChIKey PLLCFPIDBZVPMD-UHFFFAOYSA-N
Mol Weight 554.49 g/mol
Molecular Formula C25H21F3O9S
Exact Mass 554.085838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AmfAtF0D80
Name Methyl 3',4',5'-Trimethoxy-4-[2-(trifluoromethanesulfonyloxy)benzoyl]biphenyl-2-carboxylate
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Formula C25H21F3O9S
InChI InChI=1S/C25H21F3O9S/c1-33-20-12-15(13-21(34-2)23(20)35-3)16-10-9-14(11-18(16)24(30)36-4)22(29)17-7-5-6-8-19(17)37-38(31,32)25(26,27)28/h5-13H,1-4H3
InChIKey PLLCFPIDBZVPMD-UHFFFAOYSA-N
Molecular Weight 554.489 g/mol
SMILES C(S(Oc1c(C(c2cc(C(=O)OC)c(-c3cc(OC)c(c(c3)OC)OC)cc2)=O)cccc1)(=O)=O)(F)(F)F
SPLASH splash10-0udi-0001090000-753aebb815af403a9a6e
Source of Spectrum U1-2011-6677-6g
Wiley ID 1702851