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4-([3-(Ethoxycarbonyl)-4,5-dimethyl-2-thienyl]amino)-4-oxobutanoic acid
SpectraBase Compound ID Iu4VZbu6kyM
InChI InChI=1S/C13H17NO5S/c1-4-19-13(18)11-7(2)8(3)20-12(11)14-9(15)5-6-10(16)17/h4-6H2,1-3H3,(H,14,15)(H,16,17)
InChIKey CEUBXXKPXQZBDU-UHFFFAOYSA-N
Mol Weight 299.34 g/mol
Molecular Formula C13H17NO5S
Exact Mass 299.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCk9G4Ywewm
Name 4-([3-(Ethoxycarbonyl)-4,5-dimethyl-2-thienyl]amino)-4-oxobutanoic acid
CAS Registry Number 109164-40-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO5S
InChI InChI=1S/C13H17NO5S/c1-4-19-13(18)11-7(2)8(3)20-12(11)14-9(15)5-6-10(16)17/h4-6H2,1-3H3,(H,14,15)(H,16,17)
InChIKey CEUBXXKPXQZBDU-UHFFFAOYSA-N
Molecular Weight 299.341 g/mol
SMILES N(c1c(c(c(s1)C)C)C(=O)OCC)C(CCC(=O)O)=O
SPLASH splash10-0f6y-9400000000-3384f5873f3b03f63a04
Synonyms 4-[(3-carbethoxy-4,5-dimethyl-2-thienyl)amino]-4-keto-butyric acid 4-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)amino]-4-oxobutanoic acid 4-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-butanoic acid 4-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-4-oxobutanoic acid N-(3-Ethoxycarbonyl-4,5-dimethyl-2-thienyl)succinamic acid
Wiley ID 1468782