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3-(1-Hydroxyethyl)-1-phenylsulfenylpent-4-en-1-yne
SpectraBase Compound ID CHSa9J4Ja5s
InChI InChI=1S/C13H14OS/c1-3-12(11(2)14)9-10-15-13-7-5-4-6-8-13/h3-8,11-12,14H,1H2,2H3
InChIKey CKNQICHPJFNNHH-UHFFFAOYSA-N
Mol Weight 218.31 g/mol
Molecular Formula C13H14OS
Exact Mass 218.076536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4M6ntESuBTU
Name 3-(1-Hydroxyethyl)-1-phenylsulfenylpent-4-en-1-yne
Alternate Name(s) 3-[(phenylsulfanyl)ethynyl]-4-penten-2-ol
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Formula C13H14OS
InChI InChI=1S/C13H14OS/c1-3-12(11(2)14)9-10-15-13-7-5-4-6-8-13/h3-8,11-12,14H,1H2,2H3
InChIKey CKNQICHPJFNNHH-UHFFFAOYSA-N
Molecular Weight 218.314 g/mol
SMILES OC(C(C#CSc1ccccc1)C=C)C
SPLASH splash10-00di-2910000000-e5c3ae10342efdc10858
Source of Spectrum F-49-10418-12
Wiley ID 788994