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1-Methyl-6-(4-toluenesulfonyl)-4H-pyrazolo[4,3-c]pyrazole
SpectraBase Compound ID HnhPU0txfAj
InChI InChI=1S/C12H12N4O2S/c1-8-3-5-9(6-4-8)19(17,18)12-11-10(14-15-12)7-13-16(11)2/h3-7H,1-2H3,(H,14,15)
InChIKey YGJCULGFOHPGFU-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C12H12N4O2S
Exact Mass 276.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lf1zE3jx8A
Name 1-Methyl-6-(4-toluenesulfonyl)-4H-pyrazolo[4,3-c]pyrazole
Appearance White plates
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N4O2S
InChI InChI=1S/C12H12N4O2S/c1-8-3-5-9(6-4-8)19(17,18)12-11-10(14-15-12)7-13-16(11)2/h3-7H,1-2H3,(H,14,15)
InChIKey YGJCULGFOHPGFU-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p009.427
Molecular Weight 276.314 g/mol
SMILES [nH]1nc(c2[n](ncc12)C)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-004l-8190000000-b40c81ebc9e1f2c4d8f3
Source of Spectrum ARK-2016-38-7
Wiley ID 1843447