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(5E)-3-Methyl-1,5-heptadiene
SpectraBase Compound ID KHZCco21EKW
InChI InChI=1S/C8H14/c1-4-6-7-8(3)5-2/h4-6,8H,2,7H2,1,3H3/b6-4+
InChIKey QIWJMWAOAINRPL-GQCTYLIASA-N
Mol Weight 110.2 g/mol
Molecular Formula C8H14
Exact Mass 110.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ifIlhEgF7j
Name (5E)-3-Methyl-1,5-heptadiene
CAS Registry Number 50592-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14
InChI InChI=1S/C8H14/c1-4-6-7-8(3)5-2/h4-6,8H,2,7H2,1,3H3/b6-4+
InChIKey QIWJMWAOAINRPL-GQCTYLIASA-N
Molecular Weight 110.200 g/mol
SMILES CC(C=C)C\C=C\C
SPLASH splash10-0a4i-9000000000-950fa7d0b317e7f3d18d
Source of Spectrum HE-1982-0-0
Synonyms (5E)-3-methylhepta-1,5-diene 1,5-Heptadiene, 3-methyl- 1,5-Heptadiene, 3-methyl-, (E)- 3-Methyl-1,5-heptadiene
Wiley ID 1122608