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1-(4-tert-Butylphenyl)-2-[(trifluoromethyl)sulfonyloxy]anthraquinone
SpectraBase Compound ID DSgmB4Jhvgj
InChI InChI=1S/C25H19F3O5S/c1-24(2,3)15-10-8-14(9-11-15)20-19(33-34(31,32)25(26,27)28)13-12-18-21(20)23(30)17-7-5-4-6-16(17)22(18)29/h4-13H,1-3H3
InChIKey AOZDMKCKOPVYMZ-UHFFFAOYSA-N
Mol Weight 488.48 g/mol
Molecular Formula C25H19F3O5S
Exact Mass 488.090529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rNib8Mjhfd
Name 1-(4-tert-Butylphenyl)-2-[(trifluoromethyl)sulfonyloxy]anthraquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19F3O5S
InChI InChI=1S/C25H19F3O5S/c1-24(2,3)15-10-8-14(9-11-15)20-19(33-34(31,32)25(26,27)28)13-12-18-21(20)23(30)17-7-5-4-6-16(17)22(18)29/h4-13H,1-3H3
InChIKey AOZDMKCKOPVYMZ-UHFFFAOYSA-N
Molecular Weight 488.477 g/mol
SMILES C(S(Oc1c(c2C(c3ccccc3C(c2cc1)=O)=O)-c1ccc(C(C)(C)C)cc1)(=O)=O)(F)(F)F
SPLASH splash10-00di-0012900000-2ed59f836872beb76312
Source of Spectrum U1-2011-2081-5c
Wiley ID 1665543