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(3E)-7-Hydroxy-3,7,11-trimethyldodeca-1,3,10-triene-6-yl .alpha.-methoxy-.alpha.-(trifluoromethyl)phenylacetate
SpectraBase Compound ID LTiPOEMFmQN
InChI InChI=1S/C25H33F3O4/c1-7-19(4)15-16-21(23(5,30)17-11-12-18(2)3)32-22(29)24(31-6,25(26,27)28)20-13-9-8-10-14-20/h7-10,12-15,21,30H,1,11,16-17H2,2-6H3/b19-15+
InChIKey JBDDSDVDGQNESP-XDJHFCHBSA-N
Mol Weight 454.5 g/mol
Molecular Formula C25H33F3O4
Exact Mass 454.233094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BHaas75TRwG
Name (3E)-7-Hydroxy-3,7,11-trimethyldodeca-1,3,10-triene-6-yl .alpha.-methoxy-.alpha.-(trifluoromethyl)phenylacetate
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Formula C25H33F3O4
InChI InChI=1S/C25H33F3O4/c1-7-19(4)15-16-21(23(5,30)17-11-12-18(2)3)32-22(29)24(31-6,25(26,27)28)20-13-9-8-10-14-20/h7-10,12-15,21,30H,1,11,16-17H2,2-6H3/b19-15+
InChIKey JBDDSDVDGQNESP-XDJHFCHBSA-N
Molecular Weight 454.530 g/mol
SMILES OC(C(OC(C(C(F)(F)F)(c1ccccc1)OC)=O)C\C=C\(C=C)C)(CCC=C(C)C)C
SPLASH splash10-000l-9700000000-b3a1023c28a2b7712b30
Source of Spectrum SO-0-121-12
Synonyms (3E)-1-(1-hydroxy-1,5-dimethyl-4-hexenyl)-4-methyl-3,5-hexadienyl 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Wiley ID 873152