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CIS-1-METHOXY-1-(2'-METHOXYPENT-2'-ENYL)-2-(PARA-TOLYLTHIO)-CYCLOPENTANE
SpectraBase Compound ID GRJCnr65xvh
InChI InChI=1S/2C19H28O2S/c2*1-5-7-16(20-3)14-19(21-4)13-6-8-18(19)22-17-11-9-15(2)10-12-17/h2*5,9-12,16,18H,1,6-8,13-14H2,2-4H3/t16-,18+,19+;16-,18-,19-/m10/s1
InChIKey DJLJMBJSYORJOP-IPOJGNFBSA-N
Mol Weight 640.98 g/mol
Molecular Formula C38H56O4S2
Exact Mass 640.362003 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7njRFzeCLkL
Name CIS-1-METHOXY-1-(2'-METHOXYPENT-2'-ENYL)-2-(PARA-TOLYLTHIO)-CYCLOPENTANE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H56O4S2
InChI InChI=1S/2C19H28O2S/c2*1-5-7-16(20-3)14-19(21-4)13-6-8-18(19)22-17-11-9-15(2)10-12-17/h2*5,9-12,16,18H,1,6-8,13-14H2,2-4H3/t16-,18+,19+;16-,18-,19-/m10/s1
InChIKey DJLJMBJSYORJOP-IPOJGNFBSA-N
Literature Reference Author D.S.CHEKMAREV,M.I.LAZAREVA,G.V.ZATONSKY,A.V.MASKAEV,R.CAPLE, W.SMIT
Literature Reference Citation J.ORG.CHEM.,67,7957(2002)
Literature Reference DOI 10.1021/jo0261202
Molecular Weight 640.980 g/mol
Solvent CDCl3
Source File Reference UWMS23709