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Methyl 11-methoxy-3,7,11-trimethyl-10-(trifluoroacetoxy)-2,6-dodecadienoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl 11-methoxy-3,7,11-trimethyl-10-(trifluoroacetoxy)-2,6-dodecadienoate
SpectraBase Compound ID 2CSQoN4QXa4
InChI InChI=1S/C19H29F3O5/c1-13(8-7-9-14(2)12-16(23)25-5)10-11-15(18(3,4)26-6)27-17(24)19(20,21)22/h8,12,15H,7,9-11H2,1-6H3/b13-8+,14-12+
InChIKey IMPMIYIROCINER-LMLHBTEYSA-N
Mol Weight 394.43 g/mol
Molecular Formula C19H29F3O5
Exact Mass 394.196709 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJyT14FtQJ1
Name Methyl 11-methoxy-3,7,11-trimethyl-10-(trifluoroacetoxy)-2,6-dodecadienoate
Comments Computed using HOSE algorithm
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Exact Mass 394.196708518 u
Formula C19H29F3O5
InChI InChI=1S/C19H29F3O5/c1-13(8-7-9-14(2)12-16(23)25-5)10-11-15(18(3,4)26-6)27-17(24)19(20,21)22/h8,12,15H,7,9-11H2,1-6H3/b13-8+,14-12+
InChIKey IMPMIYIROCINER-LMLHBTEYSA-N
Molecular Weight 394.431 g/mol
SMILES C(C(OC(C(OC)(C)C)CC\C(=C\CC\C(=C\C(=O)OC)C)C)=O)(F)(F)F