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1-Hexanethione, 2,2-dimethyl-1-phenyl-
SpectraBase Compound ID 3yidKJlMAlb
InChI InChI=1S/C14H20S/c1-4-5-11-14(2,3)13(15)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKey TWNDMKVSSPTDGY-UHFFFAOYSA-N
Mol Weight 220.37 g/mol
Molecular Formula C14H20S
Exact Mass 220.128572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWQ0QUDR4nC
Name 1-Hexanethione, 2,2-dimethyl-1-phenyl-
CAS Registry Number 54007-71-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20S
InChI InChI=1S/C14H20S/c1-4-5-11-14(2,3)13(15)12-9-7-6-8-10-12/h6-10H,4-5,11H2,1-3H3
InChIKey TWNDMKVSSPTDGY-UHFFFAOYSA-N
Molecular Weight 220.374 g/mol
SMILES C(C(CCCC)(C)C)(=S)c1ccccc1
SPLASH splash10-00di-0910000000-cd55902137cacad6a807
Source of Spectrum C-98-6223-0
Synonyms 2,2-Dimethyl-1-phenyl-1-hexanethione 2,2-Dimethyl-1-phenylhexane-1-thione
Wiley ID 1220326