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3(2H)-thiazolepropanoic acid, 4-methyl-2-thioxo-
SpectraBase Compound ID 53ycmjllyVd
InChI InChI=1S/C7H9NO2S2/c1-5-4-12-7(11)8(5)3-2-6(9)10/h4H,2-3H2,1H3,(H,9,10)
InChIKey KZFMGQGVVIBTIH-UHFFFAOYSA-N
Mol Weight 203.27 g/mol
Molecular Formula C7H9NO2S2
Exact Mass 203.007471 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1uhP2KLD1h
Name 3(2H)-thiazolepropanoic acid, 4-methyl-2-thioxo-
Alternate Name(s) 3-(4-Methyl-2-thioxothiazol-3(2H)-yl)propanoic acid 3-(4-Methyl-2-thioxo-1,3-thiazol-3(2H)-yl)propanoic acid 3-(4-Methyl-2-sulfanylidene-3-thiazolyl)propanoic acid 3-(4-Methyl-2-thioxo-thiazol-3-yl)propanoic acid 3-(4-Methyl-2-sulfanylidene-1,3-thiazol-3-yl)propanoic acid
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Formula C7H9NO2S2
InChI InChI=1S/C7H9NO2S2/c1-5-4-12-7(11)8(5)3-2-6(9)10/h4H,2-3H2,1H3,(H,9,10)
InChIKey KZFMGQGVVIBTIH-UHFFFAOYSA-N
Molecular Weight 203.274 g/mol
SMILES OC(CCN1C(C)=CSC1=S)=O
SPLASH splash10-0ul0-9840000000-d3e40a353165bdab3f9b
Source of Spectrum JX-2015-5-707
Wiley ID 1727470