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Methyl 3-(4-hydroxypent-1-yn-1-yl)thiophene-2-carboxylate
SpectraBase Compound ID 6747a406jBh
InChI InChI=1S/C11H12O3S/c1-8(12)4-3-5-9-6-7-15-10(9)11(13)14-2/h6-8,12H,4H2,1-2H3
InChIKey IEFKXNMCHHTUPW-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 2EDbQ861sO
Name Methyl 3-(4-hydroxypent-1-yn-1-yl)thiophene-2-carboxylate
Appearance Yellow solid
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Formula C11H12O3S
InChI InChI=1S/C11H12O3S/c1-8(12)4-3-5-9-6-7-15-10(9)11(13)14-2/h6-8,12H,4H2,1-2H3
InChIKey IEFKXNMCHHTUPW-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(CC#Cc1c(C(OC)=O)scc1)C
SPLASH splash10-00m0-0900000000-d60e3bdc112e561af8d2
Source of Spectrum ASC-364-SM5-5-1
Wiley ID 1877464