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8-(Tosylamino)-8,10-diazabicyclo[5.3.0]deca-2,4,6-trien-9-one
SpectraBase Compound ID ICD5DhVXUMX
InChI InChI=1S/C21H19N3O3S/c1-16-12-14-18(15-13-16)28(26,27)22-24-20-11-7-3-6-10-19(20)23(21(24)25)17-8-4-2-5-9-17/h2-15,19,22H,1H3
InChIKey ZKIXRNBYASWTHQ-UHFFFAOYSA-N
Mol Weight 393.46 g/mol
Molecular Formula C21H19N3O3S
Exact Mass 393.114713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rwfpC1l1WE
Name 8-(Tosylamino)-8,10-diazabicyclo[5.3.0]deca-2,4,6-trien-9-one
Alternate Name(s) 10-(phenyl)-8-(Tosylamino)-8,10-diazabicyclo[5.3.0]deca-2,4,6-trien-9-one 4-Methyl-N-(2-oxo-3-phenyl-3aH-cyclohepta[d]imidazol-1-yl)benzenesulfonamide 4-Methyl-N-(2-oxidanylidene-3-phenyl-3aH-cyclohepta[d]imidazol-1-yl)benzenesulfonamide
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Formula C21H19N3O3S
InChI InChI=1S/C21H19N3O3S/c1-16-12-14-18(15-13-16)28(26,27)22-24-20-11-7-3-6-10-19(20)23(21(24)25)17-8-4-2-5-9-17/h2-15,19,22H,1H3
InChIKey ZKIXRNBYASWTHQ-UHFFFAOYSA-N
Molecular Weight 393.461 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)N1C(N(c2ccccc2)C2C1=CC=CC=C2)=O
SPLASH splash10-000l-0294000000-a6d39fd875087968a750
Source of Spectrum H1-41-1680-5
Wiley ID 757298