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1,3-(Dimethyl-7-[(4-chlorophenyl)amino]-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazinium Tetrafluoroborate
SpectraBase Compound ID 6CcLolSt0kf
InChI InChI=1S/C12H11ClN5OS.BF4/c1-7-10(19)18-12(17(2)15-7)20-11(16-18)14-9-5-3-8(13)4-6-9;2-1(3,4)5/h3-6H,1-2H3,(H,14,16);/q+1;-1
InChIKey DBAPCUBNRUGXPW-UHFFFAOYSA-N
Mol Weight 395.57 g/mol
Molecular Formula C12H11BClF4N5OS
Exact Mass 395.040202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAPtk6Saw7o
Name 1,3-(Dimethyl-7-[(4-chlorophenyl)amino]-4-oxo-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazinium Tetrafluoroborate
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Formula C12H11BClF4N5OS
InChI InChI=1S/C12H11ClN5OS.BF4/c1-7-10(19)18-12(17(2)15-7)20-11(16-18)14-9-5-3-8(13)4-6-9;2-1(3,4)5/h3-6H,1-2H3,(H,14,16);/q+1;-1
InChIKey DBAPCUBNRUGXPW-UHFFFAOYSA-N
Molecular Weight 395.571 g/mol
SMILES [B-](F)(F)(F)F.N(C1=NN2C(=[N+](C)N=C(C2=O)C)S1)c1ccc(Cl)cc1
SPLASH splash10-014i-3900000000-3cb9744e1c3c45cb85cc
Source of Spectrum F-47-6755-5
Synonyms 7-(4-Chloroanilino)-1,3-dimethyl-4-oxo-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-1-ium tetrafluoroborate
Wiley ID 1366944