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ENDO-3-(4'-TERT.-BUTYL-1'-PHENYLTHIO)-1-CHLOROMETHYL-TRICYCLO-[2.2.1.0(2,6)]-HEPTANE
SpectraBase Compound ID I6BHix9iizS
InChI InChI=1S/C18H23ClS/c1-17(2,3)12-4-6-13(7-5-12)20-16-11-8-14-15(16)18(14,9-11)10-19/h4-7,11,14-16H,8-10H2,1-3H3/t11-,14-,15-,16-,18+/m1/s1
InChIKey QMQXYFIBFJVYAY-BWCYVWJYSA-N
Mol Weight 306.9 g/mol
Molecular Formula C18H23ClS
Exact Mass 306.1209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fv28tVLt5hr
Name ENDO-3-(4'-TERT.-BUTYL-1'-PHENYLTHIO)-1-CHLOROMETHYL-TRICYCLO-[2.2.1.0(2,6)]-HEPTANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H23ClS
InChI InChI=1S/C18H23ClS/c1-17(2,3)12-4-6-13(7-5-12)20-16-11-8-14-15(16)18(14,9-11)10-19/h4-7,11,14-16H,8-10H2,1-3H3/t11-,14-,15-,16-,18+/m1/s1
InChIKey QMQXYFIBFJVYAY-BWCYVWJYSA-N
Literature Reference Author D.G.GARRATT,P.L.BEAULIEU,V.M.MORISSET
Literature Reference Citation CAN.J.CHEM.,58,1021(1980)
Literature Reference DOI 10.1139/v80-160
Molecular Weight 306.894 g/mol
Solvent CDCl3
Source File Reference UWED944