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(2E,4S,5S,6S,15R)-4,5-(ISOPROPYLIDENDIOXY)-6-[(PHENOXYTHIOCARBONYL)-OXY]-HEXADEC-2-EN-15-OLIDE
SpectraBase Compound ID 5ku8yT3y8Rl
InChI InChI=1S/C26H36O6S/c1-19-13-9-6-4-5-7-12-16-21(30-25(33)29-20-14-10-8-11-15-20)24-22(17-18-23(27)28-19)31-26(2,3)32-24/h8,10-11,14-15,17-19,21-22,24H,4-7,9,12-13,16H2,1-3H3/b18-17+/t19-,21+,22+,24+/m1/s1
InChIKey VDIBQKYDXHPUOG-IUGFLWBNSA-N
Mol Weight 476.6 g/mol
Molecular Formula C26H36O6S
Exact Mass 476.22326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4LWPgECd26C
Name (2E,4S,5S,6S,15R)-4,5-(ISOPROPYLIDENDIOXY)-6-[(PHENOXYTHIOCARBONYL)-OXY]-HEXADEC-2-EN-15-OLIDE
Compound Number 3 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O6S
InChI InChI=1S/C26H36O6S/c1-19-13-9-6-4-5-7-12-16-21(30-25(33)29-20-14-10-8-11-15-20)24-22(17-18-23(27)28-19)31-26(2,3)32-24/h8,10-11,14-15,17-19,21-22,24H,4-7,9,12-13,16H2,1-3H3/b18-17+/t19-,21+,22+,24+/m1/s1
InChIKey VDIBQKYDXHPUOG-IUGFLWBNSA-N
Literature Reference Author G.QUINKERT,F.KUEBER,W.KNAUF,M.WACKER,U.KOCH,H.BECKER,H.P.NES TLER,G.DUERNER,G.ZIM
Literature Reference Citation HELV.CHIM.ACTA,74,1853(1991)
Literature Reference DOI 10.1002/hlca.19910740828
Molecular Weight 476.628 g/mol
Solvent CDCl3
Source File Reference UWCH173