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Methyl 2-(3-hydroxy-3-phenylbut-1-yn-1-yl)thiophene-3-carboxylate
SpectraBase Compound ID Arr11bmWypj
InChI InChI=1S/C16H14O3S/c1-16(18,12-6-4-3-5-7-12)10-8-14-13(9-11-20-14)15(17)19-2/h3-7,9,11,18H,1-2H3
InChIKey KEFBHAPVKYMJMQ-UHFFFAOYSA-N
Mol Weight 286.34 g/mol
Molecular Formula C16H14O3S
Exact Mass 286.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnS9b3iXisI
Name Methyl 2-(3-hydroxy-3-phenylbut-1-yn-1-yl)thiophene-3-carboxylate
Appearance Yellow solid
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Formula C16H14O3S
InChI InChI=1S/C16H14O3S/c1-16(18,12-6-4-3-5-7-12)10-8-14-13(9-11-20-14)15(17)19-2/h3-7,9,11,18H,1-2H3
InChIKey KEFBHAPVKYMJMQ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200958
Molecular Weight 286.345 g/mol
Reported Formula C16H14O3S
SMILES OC(C#Cc1c(C(OC)=O)ccs1)(C)c1ccccc1
SPLASH splash10-014l-0390000000-efe4aab691a7173204b7
Source of Spectrum ASC-364-SM4-4-4
Wiley ID 1877461