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Methyl 5-[N-(2-Aminophenyl)amino]-6-chlorocyclopenta[1,2,3]dithiazole-4-carboxylate
SpectraBase Compound ID ITtsuQcJOci
InChI InChI=1S/C13H10ClN3O2S2/c1-19-13(18)8-10(9(14)12-11(8)17-21-20-12)16-7-5-3-2-4-6(7)15/h2-5,16H,15H2,1H3
InChIKey ACJGOQXHQBCXBB-UHFFFAOYSA-N
Mol Weight 339.82 g/mol
Molecular Formula C13H10ClN3O2S2
Exact Mass 338.990297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qzugWjT19a
Name Methyl 5-[N-(2-Aminophenyl)amino]-6-chlorocyclopenta[1,2,3]dithiazole-4-carboxylate
Alternate Name(s) 5-(2-aminoanilino)-6-chloro-4-cyclopenta[d]dithiazolecarboxylic acid methyl ester Methyl 5-(2-aminoanilino)-6-chlorocyclopenta[d]dithiazole-4-carboxylate Methyl 5-(2-aminoanilino)-6-chloro-cyclopenta[d]dithiazole-4-carboxylate Methyl 5-[(2-aminophenyl)amino]-6-chloranyl-cyclopenta[d][1,2,3]dithiazole-4-carboxylate
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Formula C13H10ClN3O2S2
InChI InChI=1S/C13H10ClN3O2S2/c1-19-13(18)8-10(9(14)12-11(8)17-21-20-12)16-7-5-3-2-4-6(7)15/h2-5,16H,15H2,1H3
InChIKey ACJGOQXHQBCXBB-UHFFFAOYSA-N
Molecular Weight 339.815 g/mol
SMILES N(C1=C(C=2C(SSN2)=C1Cl)C(=O)OC)c1c(cccc1)N
SPLASH splash10-05ec-2396000000-e461032ee44433d44bb1
Source of Spectrum F-70-9324-26
Wiley ID 1597767