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1-Methyl-1,5,9-cyclododecatriene
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 Ogb9dLowLc
Name 1-Methyl-1,5,9-cyclododecatriene
CAS Registry Number 15782-27-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Molecular Weight 176.303 g/mol
SMILES C1\C=C\CC\C=C\CC\C=C\(C1)C
SPLASH splash10-0gb9-9100000000-9c29248266f473f8c3ce
Synonyms (1E,5E,9E)-1-methylcyclododeca-1,5,9-triene 1,5,9-Cyclododecatriene, 1-methyl-, (E,E,E)-
Wiley ID 1497930