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Methyl 3-(3,3-Dimethylbut-1-yn-1-yl)thiophene-2-carboxylate
SpectraBase Compound ID DYfpQT2Kbox
InChI InChI=1S/C12H14O2S/c1-12(2,3)7-5-9-6-8-15-10(9)11(13)14-4/h6,8H,1-4H3
InChIKey ZZBGWPJWDRIBCG-UHFFFAOYSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tM6AJsANid
Name Methyl 3-(3,3-Dimethylbut-1-yn-1-yl)thiophene-2-carboxylate
Appearance Yellow oil
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Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-12(2,3)7-5-9-6-8-15-10(9)11(13)14-4/h6,8H,1-4H3
InChIKey ZZBGWPJWDRIBCG-UHFFFAOYSA-N
Instrument Name GC??MS apparatus
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000468
Molecular Weight 222.302 g/mol
Reported Formula C12H14O2S
SMILES c1sc(c(c1)C#CC(C)(C)C)C(=O)OC
SPLASH splash10-06tb-0940000000-60a19bc12c3fad5551da
Source of Spectrum U1-2020-3718-3718-6
Wiley ID 1860755