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1-PHENYL-2,2,3,3-TETRACYANO-7,8-DITHIABICYCLO-[3.2.1]-OCTANE
SpectraBase Compound ID KJGk3yK7Wtj
InChI InChI=1S/C16H10N4S2/c17-8-14(9-18)6-13-7-21-16(22-13,15(14,10-19)11-20)12-4-2-1-3-5-12/h1-5,13H,6-7H2/t13-,16+/m1/s1
InChIKey UTLHXGYDIWGALW-CJNGLKHVSA-N
Mol Weight 322.4 g/mol
Molecular Formula C16H10N4S2
Exact Mass 322.034689 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAKQ3XoFbIn
Name 1-PHENYL-2,2,3,3-TETRACYANO-7,8-DITHIABICYCLO-[3.2.1]-OCTANE
Compound Number I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H10N4S2
InChI InChI=1S/C16H10N4S2/c17-8-14(9-18)6-13-7-21-16(22-13,15(14,10-19)11-20)12-4-2-1-3-5-12/h1-5,13H,6-7H2/t13-,16+/m1/s1
InChIKey UTLHXGYDIWGALW-CJNGLKHVSA-N
Literature Reference Author I.V.MAGEDOV,S.Y.SHAPAKIN,V.N.DROZD,A.S.BATSANOV,D.S.YUFIT,Y. T.STRUCHKOV
Literature Reference Citation CHEM.HET.COMP.,30,674(1994)
Literature Reference DOI 10.1007/bf01166308
Molecular Weight 322.402 g/mol
Solvent DMF-D7
Source File Reference UWMZ13524