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2-Heptenal, 2-methyl-
SpectraBase Compound ID 4HcVQdfjztR
InChI InChI=1S/C8H14O/c1-3-4-5-6-8(2)7-9/h6-7H,3-5H2,1-2H3/b8-6+
InChIKey IGNVJMUTQIKSHB-SOFGYWHQSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xl5EzIYxfp
Name 2-Heptenal, 2-methyl-
CAS Registry Number 30567-26-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-3-4-5-6-8(2)7-9/h6-7H,3-5H2,1-2H3/b8-6+
InChIKey IGNVJMUTQIKSHB-SOFGYWHQSA-N
Molecular Weight 126.199 g/mol
SMILES CCCC\C=C/(C)C=O
SPLASH splash10-056u-9000000000-495bbf9814b7d8c473b3
Source of Spectrum AA-0-539-2
Synonyms (2E)-2-Methyl-2-heptenal (E)-2-methyl-2-heptenal (E)-2-methylhept-2-enal 2-Methyl-2-heptenal
Wiley ID 4854