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Propanenitrile, 2-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-3-(4-nitrophenyl)-3-oxo-
SpectraBase Compound ID 9UtIJCKnvRt
InChI InChI=1S/C11H4ClN3O3S2/c12-11-10(19-20-14-11)8(5-13)9(16)6-1-3-7(4-2-6)15(17)18/h1-4H/b10-8+
InChIKey ORMBQJGBPZAEEY-CSKARUKUSA-N
Mol Weight 325.74 g/mol
Molecular Formula C11H4ClN3O3S2
Exact Mass 324.938261 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dc7tTovjVsl
Name Propanenitrile, 2-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-3-(4-nitrophenyl)-3-oxo-
Alternate Name(s) (2E)-2-(4-chloranyl-1,2,3-dithiazol-5-ylidene)-3-(4-nitrophenyl)-3-oxidanylidene-propanenitrile (2E)-2-(4-chloro-5-dithiazolylidene)-3-(4-nitrophenyl)-3-oxopropanenitrile (2E)-2-(4-Chloro-5H-1,2,3-dithiazol-5-ylidene)-3-(4-nitrophenyl)-3-oxopropanenitrile (2E)-2-(4-chlorodithiazol-5-ylidene)-3-(4-nitrophenyl)-3-oxo-propanenitrile (2E)-2-(4-chlorodithiazol-5-ylidene)-3-keto-3-(4-nitrophenyl)propionitrile
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Formula C11H4ClN3O3S2
InChI InChI=1S/C11H4ClN3O3S2/c12-11-10(19-20-14-11)8(5-13)9(16)6-1-3-7(4-2-6)15(17)18/h1-4H/b10-8+
InChIKey ORMBQJGBPZAEEY-CSKARUKUSA-N
Molecular Weight 325.744 g/mol
SMILES C(#N)\C(=C\1SSN=C1Cl)C(c1ccc(cc1)N(=O)=O)=O
SPLASH splash10-0ufu-9420000000-2edc24dfaeb1453a6992
Source of Spectrum AD-0-2532-0
Wiley ID 1432175