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1,3-Benzoxathiol-2-one, 5-bromo-6-hydroxy-
SpectraBase Compound ID Gus0jXhHqBi
InChI InChI=1S/C7H3BrO3S/c8-3-1-6-5(2-4(3)9)11-7(10)12-6/h1-2,9H
InChIKey SCQGQMLODYVREA-UHFFFAOYSA-N
Mol Weight 247.06 g/mol
Molecular Formula C7H3BrO3S
Exact Mass 245.898628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXkOUCtrr7w
Name 1,3-Benzoxathiol-2-one, 5-bromo-6-hydroxy-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3BrO3S
InChI InChI=1S/C7H3BrO3S/c8-3-1-6-5(2-4(3)9)11-7(10)12-6/h1-2,9H
InChIKey SCQGQMLODYVREA-UHFFFAOYSA-N
Molecular Weight 247.062 g/mol
SMILES Oc1cc2OC(Sc2cc1Br)=O
SPLASH splash10-0007-9520000000-ad01ba77aafee4926aee
Synonyms 5-Bromanyl-6-oxidanyl-1,3-benzoxathiol-2-one 5-Bromo-6-hydroxy-1,3-benzoxathiol-2-one
Wiley ID 1455483