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Methyl 3-(3-hydroxybut-1-yn-1-yl)-4-methylthiophene-2-carboxylate
SpectraBase Compound ID 5OsTecfVOtl
InChI InChI=1S/C11H12O3S/c1-7-6-15-10(11(13)14-3)9(7)5-4-8(2)12/h6,8,12H,1-3H3
InChIKey TXUVKIJXGQNYIU-UHFFFAOYSA-N
Mol Weight 224.27 g/mol
Molecular Formula C11H12O3S
Exact Mass 224.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPh2gJc8lt9
Name Methyl 3-(3-hydroxybut-1-yn-1-yl)-4-methylthiophene-2-carboxylate
Appearance Yellow oil
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Formula C11H12O3S
InChI InChI=1S/C11H12O3S/c1-7-6-15-10(11(13)14-3)9(7)5-4-8(2)12/h6,8,12H,1-3H3
InChIKey TXUVKIJXGQNYIU-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200958
Molecular Weight 224.274 g/mol
Reported Formula C11H12O3S
SMILES OC(C#Cc1c(C(OC)=O)scc1C)C
SPLASH splash10-067j-1920000000-d7ca6d4e576aea0e1c61
Source of Spectrum ASC-364-SM3-3-4
Wiley ID 1877456