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3-Methyl-1,1-bis(methylsulfanyl)-1,3-butadiene
SpectraBase Compound ID QszkxmUvmi
InChI InChI=1S/C7H12S2/c1-6(2)5-7(8-3)9-4/h5H,1H2,2-4H3
InChIKey TYQMFKAGKCGQKJ-UHFFFAOYSA-N
Mol Weight 160.29 g/mol
Molecular Formula C7H12S2
Exact Mass 160.038043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5g4CVXJTvFJ
Name 3-Methyl-1,1-bis(methylsulfanyl)-1,3-butadiene
CAS Registry Number 67945-63-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12S2
InChI InChI=1S/C7H12S2/c1-6(2)5-7(8-3)9-4/h5H,1H2,2-4H3
InChIKey TYQMFKAGKCGQKJ-UHFFFAOYSA-N
Molecular Weight 160.293 g/mol
SMILES C(C)(C=C(SC)SC)=C
SPLASH splash10-0002-9400000000-d7f25af7761edfca72af
Source of Spectrum NP-1-9350-0
Synonyms 1,3-Butadiene, 3-methyl-1,1-bis(methylthio)- 3-Methyl-1,1-bis(methylsulfanyl)buta-1,3-diene 3-Methyl-1,1-bis(methylthio)buta-1,3-diene
Wiley ID 1099985