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3-Methyl-6-(methylthio)-2,5-hexadienal
SpectraBase Compound ID 153qy5S9igr
InChI InChI=1S/C8H12OS/c1-8(5-6-9)4-3-7-10-2/h3,5-7H,4H2,1-2H3/b7-3+,8-5+
InChIKey FFWGQQIQBNBRCB-IUMFQGNOSA-N
Mol Weight 156.24 g/mol
Molecular Formula C8H12OS
Exact Mass 156.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnCclGV1Esk
Name 3-Methyl-6-(methylthio)-2,5-hexadienal
CAS Registry Number 97370-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12OS
InChI InChI=1S/C8H12OS/c1-8(5-6-9)4-3-7-10-2/h3,5-7H,4H2,1-2H3/b7-3+,8-5+
InChIKey FFWGQQIQBNBRCB-IUMFQGNOSA-N
Molecular Weight 156.243 g/mol
SMILES C(\C(=C\C=O)C)\C=C\SC
SPLASH splash10-005a-9300000000-7e5c5790457be7e641f4
Source of Spectrum K-118-1341-3
Synonyms (2E,5E)-3-methyl-6-(methylsulfanyl)-2,5-hexadienal (2E,5E)-3-methyl-6-methylsulfanylhexa-2,5-dienal (2E,5E)-3-methyl-6-methylsulfanyl-hexa-2,5-dienal
Wiley ID 1153355