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1,1,1-Tris(methylthio)-4-phenylbutane

View entire compound with spectra: 1 MS (GC)

1,1,1-Tris(methylthio)-4-phenylbutane
SpectraBase Compound ID F0lBIdHwDHB
InChI InChI=1S/C13H20S3/c1-14-13(15-2,16-3)11-7-10-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3
InChIKey JLWOYVFCCRHXLT-UHFFFAOYSA-N
Mol Weight 272.48 g/mol
Molecular Formula C13H20S3
Exact Mass 272.072714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4mNfBuLRT0u
Name 1,1,1-Tris(methylthio)-4-phenylbutane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20S3
InChI InChI=1S/C13H20S3/c1-14-13(15-2,16-3)11-7-10-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3
InChIKey JLWOYVFCCRHXLT-UHFFFAOYSA-N
Molecular Weight 272.483 g/mol
SMILES C(SC)(SC)(SC)CCCc1ccccc1
SPLASH splash10-004i-4920000000-185ea14e07c429d89d0b
Source of Spectrum AJ-71-1944-1
Synonyms [4,4,4-Tris(methylsulfanyl)butyl]benzene
Wiley ID 774422