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3-Methyl-7-carboxaldehyde-6(E)-octenyl acetate
SpectraBase Compound ID CwRvc8uLqiw
InChI InChI=1S/C12H20O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6,9-10H,4-5,7-8H2,1-3H3/b11-6+
InChIKey HEUSWAZSUJSVCG-IZZDOVSWSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vi0jJRxAQ0
Name 3-Methyl-7-carboxaldehyde-6(E)-octenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6,9-10H,4-5,7-8H2,1-3H3/b11-6+
InChIKey HEUSWAZSUJSVCG-IZZDOVSWSA-N
Molecular Weight 212.289 g/mol
SMILES C(=O)(OCCC(CC\C=C\(C=O)C)C)C
SPLASH splash10-05nb-9000000000-bb7681d5287cac15ab94
Source of Spectrum LQ-1992-3491-0
Synonyms (6E)-3,7-dimethyl-8-oxo-6-octenyl acetate 8-Oxocitronellyl acetate Acetic acid[(E)-3,7-dimethyl-8-oxooct-6-enyl]ester Acetic acid[(E)-8-keto-3,7-dimethyl-oct-6-enyl]ester [(E)-3,7-dimethyl-8-oxidanylidene-oct-6-enyl]ethanoate [(E)-3,7-dimethyl-8-oxo-oct-6-enyl]acetate Acetic acid [(E)-3,7-dimethyl-8-oxooct-6-enyl] ester [(E)-3,7-dimethyl-8-oxooct-6-enyl] acetate [(E)-3,7-dimethyl-8-oxo-oct-6-enyl] acetate [(E)-3,7-dimethyl-8-oxidanylidene-oct-6-enyl] ethanoate
Wiley ID 1211487