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METHYL-6-(3-PHENYLTHIOBICYClO-[2.2.1]-HEPT-2-YL)-6-OXOHEXANOATE
SpectraBase Compound ID 59HTwpFwICz
InChI InChI=1S/C20H26O3S/c1-23-18(22)10-6-5-9-17(21)19-14-11-12-15(13-14)20(19)24-16-7-3-2-4-8-16/h2-4,7-8,14-15,19-20H,5-6,9-13H2,1H3/t14-,15+,19+,20-/m0/s1
InChIKey ATMZDIIPBMRLSB-BWMZKYQQSA-N
Mol Weight 346.49 g/mol
Molecular Formula C20H26O3S
Exact Mass 346.160266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1yF17OOSYv
Name METHYL-6-(3-PHENYLTHIOBICYClO-[2.2.1]-HEPT-2-YL)-6-OXOHEXANOATE
Compound Number XIX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O3S
InChI InChI=1S/C20H26O3S/c1-23-18(22)10-6-5-9-17(21)19-14-11-12-15(13-14)20(19)24-16-7-3-2-4-8-16/h2-4,7-8,14-15,19-20H,5-6,9-13H2,1H3/t14-,15+,19+,20-/m0/s1
InChIKey ATMZDIIPBMRLSB-BWMZKYQQSA-N
Literature Reference Author N.F.BONDAR,L.P.ISAENYA,R.V.SKUPSKAYA,F.A.LAKHVICH
Literature Reference Citation RUSS.J.ORG.CHEM.,38,1749(2002)
Literature Reference DOI 10.1023/A:1022559428435
Molecular Weight 346.485 g/mol
Solvent CDCl3
Source File Reference UWMZ9803