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10-hydroxy-4,6-octadecenoic acid PFB/TMS derivative
SpectraBase Compound ID IfnflZzm2Qb
InChI InChI=1S/C28H41F5O3Si/c1-5-6-7-8-11-14-17-21(36-37(2,3)4)18-15-12-9-10-13-16-19-23(34)35-20-22-24(29)26(31)28(33)27(32)25(22)30/h9-10,12-13,21H,5-8,11,14-20H2,1-4H3/b12-9+,13-10-
InChIKey CTKVNWVBYNIDLV-FMYPVGJQSA-N
Mol Weight 548.7 g/mol
Molecular Formula C28H41F5O3Si
Exact Mass 548.274513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pGlGnkTdhJ
Name 10-hydroxy-4,6-octadecenoic acid PFB/TMS derivative
Alternate Name(s) 2,3,4,5,6-pentafluorobenzyl (4Z,6E)-10-[(trimethylsilyl)oxy]-4,6-octadecadienoate
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Formula C28H41F5O3Si
InChI InChI=1S/C28H41F5O3Si/c1-5-6-7-8-11-14-17-21(36-37(2,3)4)18-15-12-9-10-13-16-19-23(34)35-20-22-24(29)26(31)28(33)27(32)25(22)30/h9-10,12-13,21H,5-8,11,14-20H2,1-4H3/b12-9+,13-10-
InChIKey CTKVNWVBYNIDLV-FMYPVGJQSA-N
Molecular Weight 548.710 g/mol
SMILES c1(c(c(F)c(c(c1F)F)F)F)COC(=O)CC\C=C/C=C/CCC(O[Si](C)(C)C)CCCCCCCC
SPLASH splash10-0a59-3950300000-98c3d36dd2e3e8147fe1
Source of Spectrum O-31-236-0
Wiley ID 1405431