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exo, endo-3,5-Bis-(phenylthio)-tricyclo-[2.2.1.0(2,6)]-heptane
SpectraBase Compound ID 2diEqbAaHD5
InChI InChI=1S/C19H18S2/c1-3-7-12(8-4-1)20-18-15-11-14-16(18)17(14)19(15)21-13-9-5-2-6-10-13/h1-10,14-19H,11H2/t14-,15+,16+,17-,18-,19-/m1/s1
InChIKey IWZLWOYQJMMBKS-PXRSPZQOSA-N
Mol Weight 310.47 g/mol
Molecular Formula C19H18S2
Exact Mass 310.084993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7fK3V4Ivfjo
Name EXO,ENDO-3,5-BIS-(PHENYLTHIO)-TRICYCLO-[2.2.1.0(2,6)]-HEPTANE
Compound Number 6/2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18S2
InChI InChI=1S/C19H18S2/c1-3-7-12(8-4-1)20-18-15-11-14-16(18)17(14)19(15)21-13-9-5-2-6-10-13/h1-10,14-19H,11H2/t14-,15+,16+,17-,18-,19-/m1/s1
InChIKey IWZLWOYQJMMBKS-PXRSPZQOSA-N
Literature Reference Author A.O.CHIZHOV,N.S.ZEFIROV,N.V.ZYK,T.C.MORRILL
Literature Reference Citation J.ORG.CHEM.,52,5647(1987)
Literature Reference DOI 10.1021/jo00235a002
Molecular Weight 310.472 g/mol
Solvent CDCl3
Source File Reference UWGB786