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4-Thiazolecarboxaldehyde, 2,3-dihydro-5-(3-pyridinyl)-2-thioxo-
SpectraBase Compound ID JcERXvhW5j7
InChI InChI=1S/C9H6N2OS2/c12-5-7-8(14-9(13)11-7)6-2-1-3-10-4-6/h1-5H,(H,11,13)
InChIKey QJJHEZJRQSVAIU-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C9H6N2OS2
Exact Mass 221.992155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcTxkBSkbOh
Name 4-Thiazolecarboxaldehyde, 2,3-dihydro-5-(3-pyridinyl)-2-thioxo-
Alternate Name(s) 5-(3-pyridinyl)-2-sulfanylidene-3H-thiazole-4-carboxaldehyde 5-(3-pyridyl)-2-thioxo-3H-thiazole-4-carbaldehyde 5-Pyridin-3-yl-2-sulfanylidene-3H-1,3-thiazole-4-carbaldehyde
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Formula C9H6N2OS2
InChI InChI=1S/C9H6N2OS2/c12-5-7-8(14-9(13)11-7)6-2-1-3-10-4-6/h1-5H,(H,11,13)
InChIKey QJJHEZJRQSVAIU-UHFFFAOYSA-N
Molecular Weight 222.280 g/mol
SMILES N1C(=C(SC1=S)c1cnccc1)C=O
SPLASH splash10-000i-7930000000-8d6b49d3fc341e7e8ead
Source of Spectrum IY-1-4410-9
Wiley ID 1652092