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2-(2',3'-Dibromo-5'-methoxy-4'-toluene-p-sulfonyloxyphenyl)-1,3-dioxolane
SpectraBase Compound ID 9S1OJs2bcqr
InChI InChI=1S/C17H16Br2O6S/c1-10-3-5-11(6-4-10)26(20,21)25-16-13(22-2)9-12(14(18)15(16)19)17-23-7-8-24-17/h3-6,9,17H,7-8H2,1-2H3
InChIKey KCQZPFWKVWXMPQ-UHFFFAOYSA-N
Mol Weight 508.18 g/mol
Molecular Formula C17H16Br2O6S
Exact Mass 505.903435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BM1FQykUc7z
Name 2-(2',3'-Dibromo-5'-methoxy-4'-toluene-p-sulfonyloxyphenyl)-1,3-dioxolane
Appearance White plates
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Formula C17H16Br2O6S
InChI InChI=1S/C17H16Br2O6S/c1-10-3-5-11(6-4-10)26(20,21)25-16-13(22-2)9-12(14(18)15(16)19)17-23-7-8-24-17/h3-6,9,17H,7-8H2,1-2H3
InChIKey KCQZPFWKVWXMPQ-UHFFFAOYSA-N
Instrument Name Hewlett Packard 5986 or Perkin Elmer ITD Ion Trap Detector
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.a14
Molecular Weight 508.177 g/mol
SMILES c1(Br)c(c(c(cc1C1OCCO1)OC)OS(c1ccc(cc1)C)(=O)=O)Br
SPLASH splash10-006y-9401000000-f0b3a5e8b57852abf27c
Source of Spectrum ARK-2004-143-14
Wiley ID 1875832