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(1S,2R,3S,4S)-5-bromanylcyclohex-5-ene-1,2,3,4-tetrol
SpectraBase Compound ID 4Tq3TmJC21D
InChI InChI=1S/C6H9BrO4/c7-2-1-3(8)5(10)6(11)4(2)9/h1,3-6,8-11H/t3-,4+,5+,6+/m0/s1
InChIKey AGYFAAMKMRARQB-SLPGGIOYSA-N
Mol Weight 225.04 g/mol
Molecular Formula C6H9BrO4
Exact Mass 223.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAqTFKwKhgM
Name (1S,2R,3S,4S)-5-bromanylcyclohex-5-ene-1,2,3,4-tetrol
Alternate Name(s) (1S,2R,3S,4S)-5-bromocyclohex-5-ene-1,2,3,4-tetrol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9BrO4
InChI InChI=1S/C6H9BrO4/c7-2-1-3(8)5(10)6(11)4(2)9/h1,3-6,8-11H/t3-,4+,5+,6+/m0/s1
InChIKey AGYFAAMKMRARQB-SLPGGIOYSA-N
Molecular Weight 225.038 g/mol
SMILES O[C@]1(C=C([C@]([C@]([C@@]1(O)[H])(O)[H])(O)[H])Br)[H]
SPLASH splash10-03xr-0900000000-d93861b7a692bc5b8eb1
Source of Spectrum J-66-6771-7
Wiley ID 1535956