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6-Bromo-5,8-dimethoxy-4((trifluoromethanesulfonyl]oxy]quinolinone
SpectraBase Compound ID JKNuZ064GUt
InChI InChI=1S/C12H9BrF3NO5S/c1-20-8-5-6(13)11(21-2)9-7(3-4-17-10(8)9)22-23(18,19)12(14,15)16/h3-5H,1-2H3
InChIKey RPBOFXQBGWEAFA-UHFFFAOYSA-N
Mol Weight 416.17 g/mol
Molecular Formula C12H9BrF3NO5S
Exact Mass 414.933691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KilxODOwOdr
Name 6-Bromo-5,8-dimethoxy-4((trifluoromethanesulfonyl]oxy]quinolinone
Alternate Name(s) 6-Bromo-5,8-dimethoxy-4-quinolinyl trifluoromethanesulfonate
CAS Registry Number 133400-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrF3NO5S
InChI InChI=1S/C12H9BrF3NO5S/c1-20-8-5-6(13)11(21-2)9-7(3-4-17-10(8)9)22-23(18,19)12(14,15)16/h3-5H,1-2H3
InChIKey RPBOFXQBGWEAFA-UHFFFAOYSA-N
Molecular Weight 416.165 g/mol
SMILES C(S(Oc1c2c(c(OC)cc(c2OC)Br)ncc1)(=O)=O)(F)(F)F
SPLASH splash10-0ff0-0290100000-c48760bd5d462ada4d14
Source of Spectrum J-56-3499-6
Wiley ID 1375865