John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=GoLlcDgZ7lL SpectraBase Spectrum ID=4wi4K2DJnAb

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4A-PHENYL-2-(2',5'-DITHIOLANO)-ADAMANTANE
SpectraBase Compound ID GoLlcDgZ7lL
InChI InChI=1S/C18H22S2/c1-2-4-13(5-3-1)17-14-8-12-9-15(11-14)18(16(17)10-12)19-6-7-20-18/h1-5,12,14-17H,6-11H2/t12-,14+,15-,16+,17+/m1/s1
InChIKey OLJBOMVZHCRBOY-SOKJMZBUSA-N
Mol Weight 302.49 g/mol
Molecular Formula C18H22S2
Exact Mass 302.116294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4wi4K2DJnAb
Name 4A-PHENYL-2-(2',5'-DITHIOLANO)-ADAMANTANE
Compound Number 3 A-PH
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22S2
InChI InChI=1S/C18H22S2/c1-2-4-13(5-3-1)17-14-8-12-9-15(11-14)18(16(17)10-12)19-6-7-20-18/h1-5,12,14-17H,6-11H2/t12-,14+,15-,16+,17+/m1/s1
InChIKey OLJBOMVZHCRBOY-SOKJMZBUSA-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 302.493 g/mol
Solvent CDCl3
Source File Reference UWBT13265
SpectraBase Batch ID 7vNlgjnylDO