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2,4,7-Octatrienoic acid, 6-methyl-2-(trifluoromethyl)-8-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-6-[(trimethylsilyl)oxy]-, ethyl ester, [1.alpha.(2E,4E,6R*,7E),6.alpha.]-(.+-.)-
SpectraBase Compound ID 4nRlG5Yzp0B
InChI InChI=1S/C24H37F3O4Si/c1-9-29-19(28)18(24(25,26)27)12-10-14-21(4,31-32(6,7)8)16-17-23-20(2,3)13-11-15-22(23,5)30-23/h10,12,14,16-17H,9,11,13,15H2,1-8H3/b14-10+,17-16+,18-12+/t21-,22?,23-/m1/s1
InChIKey IHHJVWDVNMBIBQ-IORAOJMXSA-N
Mol Weight 474.6 g/mol
Molecular Formula C24H37F3O4Si
Exact Mass 474.241321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JjCdGDgg60l
Name 2,4,7-Octatrienoic acid, 6-methyl-2-(trifluoromethyl)-8-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-6-[(trimethylsilyl)oxy]-, ethyl ester, [1.alpha.(2E,4E,6R*,7E),6.alpha.]-(.+-.)-
CAS Registry Number 134525-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37F3O4Si
InChI InChI=1S/C24H37F3O4Si/c1-9-29-19(28)18(24(25,26)27)12-10-14-21(4,31-32(6,7)8)16-17-23-20(2,3)13-11-15-22(23,5)30-23/h10,12,14,16-17H,9,11,13,15H2,1-8H3/b14-10+,17-16+,18-12+/t21-,22?,23-/m1/s1
InChIKey IHHJVWDVNMBIBQ-IORAOJMXSA-N
Molecular Weight 474.636 g/mol
SMILES [C@]12(OC2(CCCC1(C)C)C)\C=C\[C@@](\C=C\C=C\(C(F)(F)F)C(=O)OCC)(O[Si](C)(C)C)C
SPLASH splash10-00dl-9311000000-9b06692d0d744ff63473
Source of Spectrum F-47-1645-15
Synonyms 7-Oxabicyclo[4.1.0]heptane, 2,4,7-octatrienoic acid deriv. Ethyl (2E,4E,6R,7E)-6-methyl-2-(trifluoromethyl)-8-[(1R)-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-6-[(trimethylsilyl)oxy]-2,4,7-octatrienoate Ethyl (2E,4E,7E)-8-(1,2-epoxy-2,6,6-trimethyl-cyclohex-1-yl)-6-methyl-2-(trifluoromethyl)-6-(trimethylsiloxy)-2,4,7-octatrienoate
Wiley ID 1393808