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9-Oxo-9H-thioxanthene-1,4-diyl bis(trifluoromethanesulfonate)
SpectraBase Compound ID 35CoYmHDPE4
InChI InChI=1S/C15H6F6O7S3/c16-14(17,18)30(23,24)27-8-5-6-9(28-31(25,26)15(19,20)21)13-11(8)12(22)7-3-1-2-4-10(7)29-13/h1-6H
InChIKey YBWDXZIFMYJSEB-UHFFFAOYSA-N
Mol Weight 508.38 g/mol
Molecular Formula C15H6F6O7S3
Exact Mass 507.917985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Hgd4gbzj3F
Name 9-Oxo-9H-thioxanthene-1,4-diyl bis(trifluoromethanesulfonate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H6F6O7S3
InChI InChI=1S/C15H6F6O7S3/c16-14(17,18)30(23,24)27-8-5-6-9(28-31(25,26)15(19,20)21)13-11(8)12(22)7-3-1-2-4-10(7)29-13/h1-6H
InChIKey YBWDXZIFMYJSEB-UHFFFAOYSA-N
Molecular Weight 508.376 g/mol
SMILES C(S(Oc1c2c(Sc3c(C2=O)cccc3)c(cc1)OS(C(F)(F)F)(=O)=O)(=O)=O)(F)(F)F
SPLASH splash10-03di-0029030000-824480645c6dac4759a9
Source of Spectrum F-68-718-8
Wiley ID 1707491