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3-Fluoro-5,7-dimethyl-2-[(thiocarbamoyl)hydrazonomethyl]quinoline-4-carboxylic acid
SpectraBase Compound ID 7iKKj0Yk7oV
InChI InChI=1S/C14H13FN4O2S/c1-6-3-7(2)10-8(4-6)18-9(5-17-19-14(16)22)12(15)11(10)13(20)21/h3-5H,1-2H3,(H,20,21)(H3,16,19,22)/b17-5+
InChIKey SGHGSYIUGLXCRI-YAXRCOADSA-N
Mol Weight 320.34 g/mol
Molecular Formula C14H13FN4O2S
Exact Mass 320.074325 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID k5jMuPae8
Name 3-Fluoro-5,7-dimethyl-2-[(thiocarbamoyl)hydrazonomethyl]quinoline-4-carboxylic acid
Alternate Name(s) 2-{(E)-[(aminocarbothioyl)hydrazono]methyl}-3-fluoro-5,7-dimethyl-4-quinolinecarboxylic acid 2-[(E)-(carbamothioylhydrazinylidene)methyl]-3-fluoro-5,7-dimethyl-4-quinolinecarboxylic acid 2-[(E)-(carbamothioylhydrazinylidene)methyl]-3-fluoro-5,7-dimethylquinoline-4-carboxylic acid 2-[(E)-(carbamothioylhydrazono)methyl]-3-fluoro-5,7-dimethyl-quinoline-4-carboxylic acid 2-[(E)-(carbamothioylhydrazinylidene)methyl]-3-fluoranyl-5,7-dimethyl-quinoline-4-carboxylic acid
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Formula C14H13FN4O2S
InChI InChI=1S/C14H13FN4O2S/c1-6-3-7(2)10-8(4-6)18-9(5-17-19-14(16)22)12(15)11(10)13(20)21/h3-5H,1-2H3,(H,20,21)(H3,16,19,22)/b17-5+
InChIKey SGHGSYIUGLXCRI-YAXRCOADSA-N
Molecular Weight 320.342 g/mol
SMILES N(C(=S)N)\N=C\c1nc2c(c(C(=O)O)c1F)c(cc(c2)C)C
SPLASH splash10-00dr-0950000000-b7c18d01727980c9ffaf
Source of Spectrum KC-61-724-8
Wiley ID 1627197