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Methyl 3-(3-hydroxy-3-methylbut-1-yn-1-yl)-4-methylthiophene-2-carboxylate
SpectraBase Compound ID IvxTY15Krhx
InChI InChI=1S/C12H14O3S/c1-8-7-16-10(11(13)15-4)9(8)5-6-12(2,3)14/h7,14H,1-4H3
InChIKey XKVTUKLJWUXJRS-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gqfn03GNtPz
Name Methyl 3-(3-hydroxy-3-methylbut-1-yn-1-yl)-4-methylthiophene-2-carboxylate
Appearance Yellow solid
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Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-8-7-16-10(11(13)15-4)9(8)5-6-12(2,3)14/h7,14H,1-4H3
InChIKey XKVTUKLJWUXJRS-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200958
Molecular Weight 238.301 g/mol
Reported Formula C12H14O3S
SMILES OC(C#Cc1c(C(OC)=O)scc1C)(C)C
SPLASH splash10-0007-0910000000-513bb82385ac9ced80a8
Source of Spectrum ASC-364-SM2-2-2
Wiley ID 1877453