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Bicyclo[2.2.2]octane, 1-methyl-4-(methylthio)-
SpectraBase Compound ID 5TReiFIPPvC
InChI InChI=1S/C10H18S/c1-9-3-6-10(11-2,7-4-9)8-5-9/h3-8H2,1-2H3
InChIKey NFKUXWNOWDBREQ-UHFFFAOYSA-N
Mol Weight 170.31 g/mol
Molecular Formula C10H18S
Exact Mass 170.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G47n7svadPz
Name Bicyclo[2.2.2]octane, 1-methyl-4-(methylthio)-
CAS Registry Number 54461-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18S
InChI InChI=1S/C10H18S/c1-9-3-6-10(11-2,7-4-9)8-5-9/h3-8H2,1-2H3
InChIKey NFKUXWNOWDBREQ-UHFFFAOYSA-N
Molecular Weight 170.314 g/mol
SMILES CSC12CCC(CC2)(CC1)C
SPLASH splash10-0ul0-9500000000-9b9c42c404e25ff01a12
Source of Spectrum RH-0-19-0
Synonyms 1-Methyl-4-(methylsulfanyl)bicyclo[2.2.2]octane 1-Methyl-4-(methylthio)bicyclo[2.2.2]octane 1-Methyl-4-methylsulfanylbicyclo[2.2.2]octane
Wiley ID 15739