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(1E)-1-(Ethylsulfanyl)-3-methyl-1,3-butadiene
SpectraBase Compound ID JP4eZESghjx
InChI InChI=1S/C7H12S/c1-4-8-6-5-7(2)3/h5-6H,2,4H2,1,3H3/b6-5+
InChIKey FQARMWMWBYNDJR-AATRIKPKSA-N
Mol Weight 128.23 g/mol
Molecular Formula C7H12S
Exact Mass 128.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uXJzSc48es
Name (1E)-1-(Ethylsulfanyl)-3-methyl-1,3-butadiene
CAS Registry Number 49563-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12S
InChI InChI=1S/C7H12S/c1-4-8-6-5-7(2)3/h5-6H,2,4H2,1,3H3/b6-5+
InChIKey FQARMWMWBYNDJR-AATRIKPKSA-N
Molecular Weight 128.233 g/mol
SMILES CCS\C=C\C(C)=C
SPLASH splash10-0002-9100000000-14d560c62295cf4315b6
Source of Spectrum T-67-761-0
Synonyms 1,3-Butadiene, 1-(ethylthio)-3-methyl- (1E)-1-(ethylthio)-3-methyl-buta-1,3-diene (1E)-1-ethylsulfanyl-3-methyl-buta-1,3-diene (1E)-1-(ethylthio)-3-methylbuta-1,3-diene
Wiley ID 1131436