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(2-acetamido-1,4-dimethoxy-acridin-9-yl) trifluoromethanesulfonate
SpectraBase Compound ID CqCPIuEtep2
InChI InChI=1S/C18H15F3N2O6S/c1-9(24)22-12-8-13(27-2)15-14(17(12)28-3)16(29-30(25,26)18(19,20)21)10-6-4-5-7-11(10)23-15/h4-8H,1-3H3,(H,22,24)
InChIKey BIHQXQRFIYPSRH-UHFFFAOYSA-N
Mol Weight 444.38 g/mol
Molecular Formula C18H15F3N2O6S
Exact Mass 444.060292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGQHnZurClc
Name (2-acetamido-1,4-dimethoxy-acridin-9-yl) trifluoromethanesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C18H15F3N2O6S
InChI InChI=1S/C18H15F3N2O6S/c1-9(24)22-12-8-13(27-2)15-14(17(12)28-3)16(29-30(25,26)18(19,20)21)10-6-4-5-7-11(10)23-15/h4-8H,1-3H3,(H,22,24)
InChIKey BIHQXQRFIYPSRH-UHFFFAOYSA-N
Molecular Weight 444.381 g/mol
SMILES N(c1c(c2c(OS(C(F)(F)F)(=O)=O)c3c(nc2c(OC)c1)cccc3)OC)C(=O)C
SPLASH splash10-03di-0009000000-cdfcabaa1cbc90e9ae94
Source of Spectrum F-56-3707-14
Synonyms (2-acetamido-1,4-dimethoxy-acridin-9-yl) tris(fluoranyl)methanesulfonate trifluoromethanesulfonic acid (2-acetamido-1,4-dimethoxy-9-acridinyl) ester trifluoromethanesulfonic acid (2-acetamido-1,4-dimethoxy-acridin-9-yl) ester
Wiley ID 857189