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Methyl 3-amino-6-(2-phenylethynyl)thieno[3,2-b]pyridine-2-carboxylate
SpectraBase Compound ID 29PjaFwZM8V
InChI InChI=1S/C17H12N2O2S/c1-21-17(20)16-14(18)15-13(22-16)9-12(10-19-15)8-7-11-5-3-2-4-6-11/h2-6,9-10H,18H2,1H3
InChIKey WDFFZJVCSLOIAY-UHFFFAOYSA-N
Mol Weight 308.36 g/mol
Molecular Formula C17H12N2O2S
Exact Mass 308.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJ3Z094YhH1
Name Methyl 3-amino-6-(2-phenylethynyl)thieno[3,2-b]pyridine-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C17H12N2O2S
InChI InChI=1S/C17H12N2O2S/c1-21-17(20)16-14(18)15-13(22-16)9-12(10-19-15)8-7-11-5-3-2-4-6-11/h2-6,9-10H,18H2,1H3
InChIKey WDFFZJVCSLOIAY-UHFFFAOYSA-N
Molecular Weight 308.355 g/mol
SMILES Nc1c(sc2cc(C#Cc3ccccc3)cnc12)C(=O)OC
SPLASH splash10-0a6r-0059000000-7ed0c50eb8292eea2212
Source of Spectrum F2-46-238-2a
Synonyms 3-amino-6-(2-phenylethynyl)-2-thieno[3,2-b]pyridinecarboxylic acid methyl ester methyl 3-azanyl-6-(2-phenylethynyl)thieno[3,2-b]pyridine-2-carboxylate
Wiley ID 1689841