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2-amino-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester
SpectraBase Compound ID 9mvB1V6EG6i
InChI InChI=1S/C11H17NO2S/c1-4-14-11(13)9-8(5-7(2)3)6-15-10(9)12/h6-7H,4-5,12H2,1-3H3
InChIKey WKTSGSNDSJZXHT-UHFFFAOYSA-N
Mol Weight 227.32 g/mol
Molecular Formula C11H17NO2S
Exact Mass 227.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID y5ys7gXR7t
Name 2-amino-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C11H17NO2S
InChI InChI=1S/C11H17NO2S/c1-4-14-11(13)9-8(5-7(2)3)6-15-10(9)12/h6-7H,4-5,12H2,1-3H3
InChIKey WKTSGSNDSJZXHT-UHFFFAOYSA-N
Molecular Weight 227.322 g/mol
SMILES Nc1c(c(cs1)CC(C)C)C(=O)OCC
SPLASH splash10-002r-0980000000-85743f20833472e8d00d
Source of Spectrum AH-127-302-4
Synonyms 2-amino-4-isobutyl-thiophene-3-carboxylic acid ethyl ester ethyl 2-amino-4-(2-methylpropyl)thiophene-3-carboxylate ethyl 2-amino-4-isobutyl-thiophene-3-carboxylate ethyl 2-azanyl-4-(2-methylpropyl)thiophene-3-carboxylate
Wiley ID 1228475