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2-Amino-4-oxo-4-(3,4,5-trichloro-2-thienyl)butanoic acid
SpectraBase Compound ID 1c1sbb5QzWw
InChI InChI=1S/C8H6Cl3NO3S/c9-4-5(10)7(11)16-6(4)3(13)1-2(12)8(14)15/h2H,1,12H2,(H,14,15)
InChIKey QOAMMBGWLWUOGJ-UHFFFAOYSA-N
Mol Weight 302.56 g/mol
Molecular Formula C8H6Cl3NO3S
Exact Mass 300.913397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mGKELs0LA
Name 2-Amino-4-oxo-4-(3,4,5-trichloro-2-thienyl)butanoic acid
Alternate Name(s) 2-Amino-4-keto-4-(3,4,5-trichloro-2-thienyl)butyric acid 2-Amino-4-oxo-4-(3,4,5-trichloro-2-thiophenyl)butanoic acid 2-Amino-4-oxo-4-(3,4,5-trichlorothiophen-2-yl)butanoic acid 2-Ammonio-4-keto-4-(3,4,5-trichloro-2-thienyl)butyrate 2-Ammonio-4-oxo-4-(3,4,5-trichloro-2-thiophenyl)butanoate 2-Azaniumyl-4-oxidanylidene-4-[3,4,5-tris(chloranyl)thiophen-2-yl]butanoate 2-Azaniumyl-4-oxo-4-(3,4,5-trichloro-2-thienyl)butanoate 2-Azaniumyl-4-oxo-4-(3,4,5-trichlorothiophen-2-yl)butanoate 2-Azanyl-4-oxidanylidene-4-[3,4,5-tris(chloranyl)thiophen-2-yl]butanoic acid
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Formula C8H6Cl3NO3S
InChI InChI=1S/C8H6Cl3NO3S/c9-4-5(10)7(11)16-6(4)3(13)1-2(12)8(14)15/h2H,1,12H2,(H,14,15)
InChIKey QOAMMBGWLWUOGJ-UHFFFAOYSA-N
Molecular Weight 302.559 g/mol
SMILES OC(C(CC(c1c(c(Cl)c(s1)Cl)Cl)=O)N)=O
SPLASH splash10-0300-1490000000-84baecdc668f520481cb
Wiley ID 1451109