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Ethyl (2E,4E,6E)-7-formyl-3-(trifluoromethane)octa-2,4,6-trienoate
SpectraBase Compound ID 8MiCYeE8GLV
InChI InChI=1S/C12H13F3O3/c1-3-18-11(17)7-10(12(13,14)15)6-4-5-9(2)8-16/h4-8H,3H2,1-2H3/b6-4+,9-5+,10-7+
InChIKey IWXCUSDUIOMJLH-NSXGYBAASA-N
Mol Weight 262.23 g/mol
Molecular Formula C12H13F3O3
Exact Mass 262.081679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10iHD7Cz7qL
Name Ethyl (2E,4E,6E)-7-formyl-3-(trifluoromethane)octa-2,4,6-trienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13F3O3
InChI InChI=1S/C12H13F3O3/c1-3-18-11(17)7-10(12(13,14)15)6-4-5-9(2)8-16/h4-8H,3H2,1-2H3/b6-4+,9-5+,10-7+
InChIKey IWXCUSDUIOMJLH-NSXGYBAASA-N
Molecular Weight 262.228 g/mol
SMILES C(\C(=C\C(=O)OCC)\C=C\C=C\(C=O)C)(F)(F)F
SPLASH splash10-015l-1390000000-19c640c1d138323d1e01
Source of Spectrum F-55-13786-7
Synonyms Ethyl (2E,4E,6E)-7-formyl-3-(trifluoromethyl)octa-2,4,6-trienoate Ethyl (2E,4E,6E)-7-methyl-8-oxo-3-(trifluoromethyl)-2,4,6-octatrienoate
Wiley ID 839936