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3-(4-Chlorophenyl)-1-(2-(methylthio)phenyl)prop-2-yn-1-ol
SpectraBase Compound ID LEmXhe5CZTz
InChI InChI=1S/C16H13ClOS/c1-19-16-5-3-2-4-14(16)15(18)11-8-12-6-9-13(17)10-7-12/h2-7,9-10,15,18H,1H3
InChIKey PQHVIGOZAMLACS-UHFFFAOYSA-N
Mol Weight 288.79 g/mol
Molecular Formula C16H13ClOS
Exact Mass 288.037564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHDNsfP2rzq
Name 3-(4-Chlorophenyl)-1-(2-(methylthio)phenyl)prop-2-yn-1-ol
Appearance Yellow oil
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Formula C16H13ClOS
InChI InChI=1S/C16H13ClOS/c1-19-16-5-3-2-4-14(16)15(18)11-8-12-6-9-13(17)10-7-12/h2-7,9-10,15,18H,1H3
InChIKey PQHVIGOZAMLACS-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202100782
Molecular Weight 288.792 g/mol
Reported Formula C16H13ClOS
SMILES OC(c1c(SC)cccc1)C#Cc1ccc(cc1)Cl
SPLASH splash10-00fr-0390000000-4f88fe885cc0ed2fff61
Source of Spectrum ASC-363-SM3-1f
Wiley ID 1851311