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(E,Z)-1,3,5-Octatriene
SpectraBase Compound ID HoToxCPhMFI
InChI InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3,5-8H,1,4H2,2H3/b7-5+,8-6-
InChIKey HOXGZVUCAYFWGR-YMBWGVAGSA-N
Mol Weight 108.18 g/mol
Molecular Formula C8H12
Exact Mass 108.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sqZuIDCHuW
Name 1,3,5-Octatriene, (E,Z)-
CAS Registry Number 40087-61-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12
InChI InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3,5-8H,1,4H2,2H3/b7-5+,8-6-
InChIKey HOXGZVUCAYFWGR-YMBWGVAGSA-N
Molecular Weight 108.184 g/mol
SMILES CC\C=C/C=C/C=C
SPLASH splash10-004l-9100000000-17507fed5597e559f51b
Source of Spectrum W5-1989-8335-1
Synonyms (3E,5Z)-1,3,5-Octatriene (3E,5Z)-octa-1,3,5-triene 1,3-trans,5-cis-Octatriene
Wiley ID 1121897