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Benzenesulfonic acid, 2-[4,6-bis(dimethylamino)-S-triazine-2-yl]hydrazide
SpectraBase Compound ID Logx6rkPbPb
InChI InChI=1S/C13H19N7O2S/c1-19(2)12-14-11(15-13(16-12)20(3)4)17-18-23(21,22)10-8-6-5-7-9-10/h5-9,18H,1-4H3,(H,14,15,16,17)
InChIKey BAGAKDHLEOFBPH-UHFFFAOYSA-N
Mol Weight 337.4 g/mol
Molecular Formula C13H19N7O2S
Exact Mass 337.132094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CjCmlrCa0Qo
Name Benzenesulfonic acid, 2-[4,6-bis(dimethylamino)-S-triazine-2-yl]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 337.132094052 u
Formula C13H19N7O2S
InChI InChI=1S/C13H19N7O2S/c1-19(2)12-14-11(15-13(16-12)20(3)4)17-18-23(21,22)10-8-6-5-7-9-10/h5-9,18H,1-4H3,(H,14,15,16,17)
InChIKey BAGAKDHLEOFBPH-UHFFFAOYSA-N
Molecular Weight 337.402 g/mol
SMILES N(C1=NC(=NC(=N1)N(C)C)N(C)C)NS(=O)(=O)C=1C=CC=CC1