For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

#49+#50;MIXTURE;(2E,4SR,5RS,9RS,10Z,12SR)+(2E,4SR,5RS,9SR,10Z,12RS)-5,9-DI-(BENZYLOXY)-4,10-DIMETHYL-12-(METHYLSULFONYL)-TRIDECA-2,10-DIENE-7-ONE

View entire compound with spectra: 1 NMR

#49+#50;MIXTURE;(2E,4SR,5RS,9RS,10Z,12SR)+(2E,4SR,5RS,9SR,10Z,12RS)-5,9-DI-(BENZYLOXY)-4,10-DIMETHYL-12-(METHYLSULFONYL)-TRIDECA-2,10-DIENE-7-ONE
SpectraBase Compound ID AIb5snTSNJf
InChI InChI=1S/2C30H40O5S/c2*1-6-13-23(2)29(34-21-26-14-9-7-10-15-26)19-28(31)20-30(24(3)18-25(4)36(5,32)33)35-22-27-16-11-8-12-17-27/h2*6-18,23,25,29-30H,19-22H2,1-5H3/b2*13-6+,24-18-/t23-,25+,29+,30-;23-,25-,29+,30-/m11/s1
InChIKey PFBSRHCSIOCTGA-QOWWKNAMSA-N
Mol Weight 1025.4 g/mol
Molecular Formula C60H80O10S2
Exact Mass 1024.519291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7sGFmh39PuS
Name #49+#50;MIXTURE;(2E,4SR,5RS,9RS,10Z,12SR)+(2E,4SR,5RS,9SR,10Z,12RS)-5,9-DI-(BENZYLOXY)-4,10-DIMETHYL-12-(METHYLSULFONYL)-TRIDECA-2,10-DIENE-7-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H80O10S2
InChI InChI=1S/2C30H40O5S/c2*1-6-13-23(2)29(34-21-26-14-9-7-10-15-26)19-28(31)20-30(24(3)18-25(4)36(5,32)33)35-22-27-16-11-8-12-17-27/h2*6-18,23,25,29-30H,19-22H2,1-5H3/b2*13-6+,24-18-/t23-,25+,29+,30-;23-,25-,29+,30-/m11/s1
InChIKey PFBSRHCSIOCTGA-QOWWKNAMSA-N
Literature Reference Author V.NARKEVITCH,S.MEGEVAND,K.SCHENK,P.VOGEL
Literature Reference Citation J.ORG.CHEM.,66,5080(2001)
Literature Reference DOI 10.1021/jo0101712
Molecular Weight 1025.409 g/mol
Solvent CDCl3
Source File Reference UWLU27123