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1,5,9-Cyclododecatriene, 1-methyl-, (E,E,E)-
SpectraBase Compound ID 5FxF7QWnAbn
InChI InChI=1S/C13H20/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h3,5-6,8,11H,2,4,7,9-10,12H2,1H3/b5-3+,8-6+,13-11+
InChIKey VJHWJWRAAFGNQY-KNNXMIQQSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtRgJjufzcy
Name 1,5,9-CYCLODODECATRIENE, 1-METHYL-, (E,E,E)-
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Formula C13H20
InChI InChI=1S/C13H20/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h3,5-6,8,11H,2,4,7,9-10,12H2,1H3/b5-3+,8-6+,13-11+
InChIKey VJHWJWRAAFGNQY-KNNXMIQQSA-N
Instrument Name CH7
Molecular Weight 176.1560
SMILES C1C\C=C\CC\C=C\CC\C(C)=C\1
SPLASH splash10-0gb9-9100000000-f4833b97ad9bdb97fdb0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany