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2-amino-4-isobutyl-thiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID 3BuKBNPDwZT
InChI InChI=1S/C10H15NO2S/c1-6(2)4-7-5-14-9(11)8(7)10(12)13-3/h5-6H,4,11H2,1-3H3
InChIKey XVYAEAXXDWJBDM-UHFFFAOYSA-N
Mol Weight 213.29 g/mol
Molecular Formula C10H15NO2S
Exact Mass 213.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSPQVQTpxbb
Name 2-amino-4-(2-methylpropyl)-3-thiophenecarboxylic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C10H15NO2S
InChI InChI=1S/C10H15NO2S/c1-6(2)4-7-5-14-9(11)8(7)10(12)13-3/h5-6H,4,11H2,1-3H3
InChIKey XVYAEAXXDWJBDM-UHFFFAOYSA-N
Molecular Weight 213.295 g/mol
SMILES Nc1c(c(cs1)CC(C)C)C(=O)OC
SPLASH splash10-0229-0950000000-bd52425da91d8cc99f3e
Source of Spectrum AH-127-301-4
Synonyms 2-amino-4-isobutyl-thiophene-3-carboxylic acid methyl ester methyl 2-amino-4-(2-methylpropyl)thiophene-3-carboxylate methyl 2-amino-4-isobutyl-thiophene-3-carboxylate methyl 2-azanyl-4-(2-methylpropyl)thiophene-3-carboxylate
Wiley ID 1212458