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Methyl 3-(4-Methyl-1,4-hexadienyl)butanoate
SpectraBase Compound ID A6Tkl5cDLoq
InChI InChI=1S/C12H18O2/c1-9-4-6-11(7-5-9)10(2)8-12(13)14-3/h4,6,10H,5,7-8H2,1-3H3
InChIKey PXDVFSQBLWUYHA-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNiFBBi7bPa
Name Methyl 3-(4-Methyl-1,4-hexadienyl)butanoate
Alternate Name(s) 3-(4-Methyl-1-cyclohexa-1,3-dienyl)butanoic acid methyl ester Methyl 3-(4-methylcyclohexa-1,3-dien-1-yl)butanoate
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-9-4-6-11(7-5-9)10(2)8-12(13)14-3/h4,6,10H,5,7-8H2,1-3H3
InChIKey PXDVFSQBLWUYHA-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C1(=CC=C(CC1)C)C(CC(=O)OC)C
SPLASH splash10-0596-2900000000-2ae31429464f07ff5996
Source of Spectrum C-115-1256-33
Wiley ID 1191229