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(3E)-5,7-dimethylocta-3,5,6-trienoic acid ethyl ester
SpectraBase Compound ID A0JX2O0PO6H
InChI InChI=1S/C12H18O2/c1-5-14-12(13)8-6-7-11(4)9-10(2)3/h6-7H,5,8H2,1-4H3/b7-6+
InChIKey SHBTVBJEZMHXNE-VOTSOKGWSA-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 AXgvyldS0EX
Name (3E)-5,7-dimethylocta-3,5,6-trienoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-5-14-12(13)8-6-7-11(4)9-10(2)3/h6-7H,5,8H2,1-4H3/b7-6+
InChIKey SHBTVBJEZMHXNE-VOTSOKGWSA-N
Molecular Weight 194.274 g/mol
SMILES C(C\C=C\C(=C=C(C)C)C)(=O)OCC
SPLASH splash10-00dl-0900000000-5f0a86647562c82edbd3
Source of Spectrum U-1996-1495-11
Synonyms ethyl (3E)-5,7-dimethylocta-3,5,6-trienoate
Wiley ID 768922