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(5E)-4-Methyl-1,5-heptadiene
SpectraBase Compound ID DvV11AyPQiO
InChI InChI=1S/C8H14/c1-4-6-8(3)7-5-2/h4-5,7-8H,1,6H2,2-3H3/b7-5+
InChIKey ITKKJSFRRSLPHX-FNORWQNLSA-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 AtQHToSI7Fs
Name (5E)-4-Methyl-1,5-heptadiene
CAS Registry Number 998-94-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14
InChI InChI=1S/C8H14/c1-4-6-8(3)7-5-2/h4-5,7-8H,1,6H2,2-3H3/b7-5+
InChIKey ITKKJSFRRSLPHX-FNORWQNLSA-N
Molecular Weight 110.200 g/mol
SMILES C\C=C\C(C)CC=C
SPLASH splash10-014l-9000000000-fdb6247bbbf86043eebd
Source of Spectrum NP-0-3108-0
Synonyms (5E)-4-methylhepta-1,5-diene 4-Methyl-1,5-Heptadiene
Wiley ID 1095316