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Methyl 3-(3-hydroxy-3-methylpent-1-yn-1-yl)thiophene-2-carboxylate
SpectraBase Compound ID 4HZySQ186fv
InChI InChI=1S/C12H14O3S/c1-4-12(2,14)7-5-9-6-8-16-10(9)11(13)15-3/h6,8,14H,4H2,1-3H3
InChIKey OFKLFIHWRFCRCL-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 Ed91UMczOas
Name Methyl 3-(3-hydroxy-3-methylpent-1-yn-1-yl)thiophene-2-carboxylate
Appearance Yellow solid
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Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-4-12(2,14)7-5-9-6-8-16-10(9)11(13)15-3/h6,8,14H,4H2,1-3H3
InChIKey OFKLFIHWRFCRCL-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)scc1)(C)CC
SPLASH splash10-0570-0930000000-e39b20ac473cdb4b9f6d
Source of Spectrum ASC-364-SM2-2-3
Wiley ID 1877454