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3-Benzylthio-2-(3-hydroxy-3-methyl-1-butynyl)thiophene
SpectraBase Compound ID 4VIkATFENU5
InChI InChI=1S/C16H16OS2/c1-16(2,17)10-8-14-15(9-11-18-14)19-12-13-6-4-3-5-7-13/h3-7,9,11,17H,12H2,1-2H3
InChIKey DTMGCLQQWMLOLV-UHFFFAOYSA-N
Mol Weight 288.42 g/mol
Molecular Formula C16H16OS2
Exact Mass 288.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gj0zGnN8Tvf
Name 3-Benzylthio-2-(3-hydroxy-3-methyl-1-butynyl)thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16OS2
InChI InChI=1S/C16H16OS2/c1-16(2,17)10-8-14-15(9-11-18-14)19-12-13-6-4-3-5-7-13/h3-7,9,11,17H,12H2,1-2H3
InChIKey DTMGCLQQWMLOLV-UHFFFAOYSA-N
Molecular Weight 288.423 g/mol
SMILES OC(C#Cc1c(ccs1)SCc1ccccc1)(C)C
SPLASH splash10-0006-9060000000-a989dfa440960be047a1
Source of Spectrum F-53-7517-12
Synonyms 4-[3-(benzylsulfanyl)-2-thienyl]-2-methyl-3-butyn-2-ol
Wiley ID 802406