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5,10-Dimethoxy-7-hydroxy-1-(trifluoromethanesulfonyl)anthracene-4-one
SpectraBase Compound ID KYD2rSUFzCE
InChI InChI=1S/C17H15F3O7S/c1-25-12-7-8(21)6-10-14(12)16(26-2)13-9(4-3-5-11(13)22)15(10)27-28(23,24)17(18,19)20/h6-7,21H,3-5H2,1-2H3
InChIKey MXRUJJJFOHQMNN-UHFFFAOYSA-N
Mol Weight 420.36 g/mol
Molecular Formula C17H15F3O7S
Exact Mass 420.049058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1x1hgeDn07u
Name 5,10-Dimethoxy-7-hydroxy-1-(trifluoromethanesulfonyl)anthracene-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F3O7S
InChI InChI=1S/C17H15F3O7S/c1-25-12-7-8(21)6-10-14(12)16(26-2)13-9(4-3-5-11(13)22)15(10)27-28(23,24)17(18,19)20/h6-7,21H,3-5H2,1-2H3
InChIKey MXRUJJJFOHQMNN-UHFFFAOYSA-N
Molecular Weight 420.355 g/mol
SMILES Oc1cc(c2c(c(OS(C(F)(F)F)(=O)=O)c3c(C(=O)CCC3)c2OC)c1)OC
SPLASH splash10-000i-0093000000-04198a3cc8f8f75ff06b
Source of Spectrum SO-0-83-24
Synonyms 5,10-Dimethoxy-7-hydroxy-1-(trifluoromethanesulfonyl-oxy)-1,2,3,4-tetrahydro-anthracene-4-one Trifluoromethanesulfonic acid (7-hydroxy-5,10-dimethoxy-4-oxo-2,3-dihydro-1H-anthracen-9-yl) ester (7-hydroxy-5,10-dimethoxy-4-oxo-2,3-dihydro-1H-anthracen-9-yl) trifluoromethanesulfonate (5,10-dimethoxy-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-anthracen-9-yl) tris(fluoranyl)methanesulfonate
Wiley ID 876161