John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Adym0RuzRAV SpectraBase Spectrum ID=PFwfpRpT7l

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4A-BROMO-2-(2',5'-DITHIOLANO)-ADAMANTANE
SpectraBase Compound ID Adym0RuzRAV
InChI InChI=1S/C12H17BrS2/c13-11-8-3-7-4-9(6-8)12(10(11)5-7)14-1-2-15-12/h7-11H,1-6H2/t7-,8+,9-,10+,11+/m1/s1
InChIKey VNDQHWOPDBFVGI-XXFSISAASA-N
Mol Weight 305.29 g/mol
Molecular Formula C12H17BrS2
Exact Mass 303.995505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID PFwfpRpT7l
Name 4E-BROMO-2-(2',5'-DITHIOLANO)-ADAMANTANE
Compound Number 3E -BR
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17BrS2
InChI InChI=1S/C12H17BrS2/c13-11-8-3-7-4-9(6-8)12(10(11)5-7)14-1-2-15-12/h7-11H,1-6H2/t7-,8+,9-,10+,11+/m1/s1
InChIKey VNDQHWOPDBFVGI-XXFSISAASA-N
Literature Reference Author H.DUDDECK,G.TOTH,A.SIMON,E.D.GOMEZ,J.T.MATTIZA
Literature Reference Citation MAGN.RES.CHEM.,49,328(2011)
Literature Reference DOI 10.1002/mrc.2751
Molecular Weight 305.291 g/mol
Solvent CDCl3
Source File Reference UWBT13260
SpectraBase Batch ID 8LztIUoLF6Y