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2,4-Hexadiene, 2-methyl-
SpectraBase Compound ID 81Yu0cpiNMN
InChI InChI=1S/C7H12/c1-4-5-6-7(2)3/h4-6H,1-3H3/b5-4+
InChIKey PRTJSZPCEHPORP-SNAWJCMRSA-N
Mol Weight 96.17 g/mol
Molecular Formula C7H12
Exact Mass 96.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETkBwKvE2ee
Name 2,4-Hexadiene, 2-methyl-
CAS Registry Number 28823-41-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12
InChI InChI=1S/C7H12/c1-4-5-6-7(2)3/h4-6H,1-3H3/b5-4+
InChIKey PRTJSZPCEHPORP-SNAWJCMRSA-N
Molecular Weight 96.173 g/mol
SMILES CC(C)=C\C=C\C
SPLASH splash10-001i-9000000000-41a2bf33cf4cf1f898f6
Source of Spectrum AD-0-237-0
Synonyms (4E)-2-Methyl-2,4-hexadiene (4E)-2-methylhexa-2,4-diene 2-Methyl-2,4-hexadiene (E)-2-methylhexa-2,4-diene
Wiley ID 68515