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4-Octenoic acid, 2,3,7-trimethyl-, methyl ester
SpectraBase Compound ID 9us2Nk7ZZsA
InChI InChI=1S/C12H22O2/c1-9(2)7-6-8-10(3)11(4)12(13)14-5/h6,8-11H,7H2,1-5H3/b8-6+
InChIKey XFAINYLZAKVHEM-SOFGYWHQSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5OahJCfQm6m
Name
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Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-9(2)7-6-8-10(3)11(4)12(13)14-5/h6,8-11H,7H2,1-5H3/b8-6+
InChIKey XFAINYLZAKVHEM-SOFGYWHQSA-N
Molecular Weight 198.1614
SMILES CC(C\C=C\C(C(C(OC)=O)C)C)C
SPLASH splash10-0670-9200000000-2e9b935ec687fe0f2a38
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany