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1-((4-Methylphenyl)sulfonylamino)-4,5,6,7(1H)-tetrahydrobenzo(d)triazole
SpectraBase Compound ID InNQ6SmY3TI
InChI InChI=1S/C13H16N4O2S/c1-10-6-8-11(9-7-10)20(18,19)16-17-13-5-3-2-4-12(13)14-15-17/h6-9,16H,2-5H2,1H3
InChIKey ATGVGYJTUQLGEK-UHFFFAOYSA-N
Mol Weight 292.36 g/mol
Molecular Formula C13H16N4O2S
Exact Mass 292.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXDDpc4ADdb
Name 1-((4-Methylphenyl)sulfonylamino)-4,5,6,7(1H)-tetrahydrobenzo(d)triazole
Alternate Name(s) 4-Methyl-N-(4,5,6,7-tetrahydro-1H-1,2,3-benzotriazol-1-yl)benzenesulfonamide 4-Methyl-N-(4,5,6,7-tetrahydrobenzotriazol-1-yl)benzenesulfonamide
CAS Registry Number 3400-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N4O2S
InChI InChI=1S/C13H16N4O2S/c1-10-6-8-11(9-7-10)20(18,19)16-17-13-5-3-2-4-12(13)14-15-17/h6-9,16H,2-5H2,1H3
InChIKey ATGVGYJTUQLGEK-UHFFFAOYSA-N
Molecular Weight 292.357 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[n]1nnc2c1CCCC2
SPLASH splash10-053u-9500000000-fdc10f41461e3ddc7b23
Source of Spectrum O-23-795-2
Wiley ID 1295059