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1-bromo-7-(bromomethyl)-2,6-adamantanediol, dimethanesulfonate
SpectraBase Compound ID 6dp7NYx6ylM
InChI InChI=1S/C13H20Br2O6S2/c1-22(16,17)20-10-9-3-8-4-12(10,7-14)6-13(15,5-9)11(8)21-23(2,18)19/h8-11H,3-7H2,1-2H3/t8-,9-,10?,11?,12+,13-/m1/s1
InChIKey ZXYLUZAIVBAQKU-GDRXYTPYSA-N
Mol Weight 496.23 g/mol
Molecular Formula C13H20Br2O6S2
Exact Mass 493.906807 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HBOUT9ZC7m2
Name 1-BROMO-7-(BROMOMETHYL)-2,6-ADAMANTANEDIOL, DIMETHANESULFONATE
Source of Sample J. Kuszmann, Institute For Drug Research, Budapest, Hungary
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20Br2O6S2
InChI InChI=1S/C13H20Br2O6S2/c1-22(16,17)20-10-9-3-8-4-12(10,7-14)6-13(15,5-9)11(8)21-23(2,18)19/h8-11H,3-7H2,1-2H3/t8-,9-,10?,11?,12+,13-/m1/s1
InChIKey ZXYLUZAIVBAQKU-GDRXYTPYSA-N
Literature Reference TETRAHEDRON 42, 2523(1986) Abstract-Chemical Abstracts= 106, 175817F(1987)
Melting Point 136-137C
Molecular Weight 496.237000
Synonyms 2,6-ADAMANTANEDIOL, 1-BROMO-7-/BROMO- METHYL/-, DIMETHANESULFONATE
Technique KBr WAFER