For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Rel-(2R,4S,5R)-4-(2',3'-Dibromo-5'-methoxy-4'-toluene-p-sulfonyloxyphenyl)-2,5-dimethyl-1,3-dioxolane
SpectraBase Compound ID 9frZhyA4Atj
InChI InChI=1S/C19H20Br2O6S/c1-10-5-7-13(8-6-10)28(22,23)27-19-15(24-4)9-14(16(20)17(19)21)18-11(2)25-12(3)26-18/h5-9,11-12,18H,1-4H3/t11-,12-,18-/m1/s1
InChIKey CRTYPMFGNGZBGA-SEDUGSJDSA-N
Mol Weight 536.23 g/mol
Molecular Formula C19H20Br2O6S
Exact Mass 533.934736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HCbxiUjrY3j
Name Rel-(2R,4S,5R)-4-(2',3'-Dibromo-5'-methoxy-4'-toluene-p-sulfonyloxyphenyl)-2,5-dimethyl-1,3-dioxolane
Appearance White plates
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20Br2O6S
InChI InChI=1S/C19H20Br2O6S/c1-10-5-7-13(8-6-10)28(22,23)27-19-15(24-4)9-14(16(20)17(19)21)18-11(2)25-12(3)26-18/h5-9,11-12,18H,1-4H3/t11-,12-,18-/m1/s1
InChIKey CRTYPMFGNGZBGA-SEDUGSJDSA-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 536.231 g/mol
SMILES c1(Br)c(cc(c(c1Br)OS(c1ccc(cc1)C)(=O)=O)OC)[C@@]1(O[C@@](O[C@@]1(C)[H])(C)[H])[H]
SPLASH splash10-0006-9320000000-33a1736c6a494c365d9d
Source of Spectrum ARK-2004-145-21
Wiley ID 1875837