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1-(4-TOLUENESULFONYL)-3,4,5-TRIBROMO-1H-PYRAZOLE
SpectraBase Compound ID 9o9yX52U0kb
InChI InChI=1S/C10H7Br3N2O2S/c1-6-2-4-7(5-3-6)18(16,17)15-10(13)8(11)9(12)14-15/h2-5H,1H3
InChIKey XOMLEAACPRBQMI-UHFFFAOYSA-N
Mol Weight 458.95 g/mol
Molecular Formula C10H7Br3N2O2S
Exact Mass 455.777838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54LOiRvNPvn
Name 3,4,5-Tribromo-1-(4-toluenesulfonyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7Br3N2O2S
InChI InChI=1S/C10H7Br3N2O2S/c1-6-2-4-7(5-3-6)18(16,17)15-10(13)8(11)9(12)14-15/h2-5H,1H3
InChIKey XOMLEAACPRBQMI-UHFFFAOYSA-N
Molecular Weight 458.950 g/mol
SMILES c1([n](nc(c1Br)Br)S(c1ccc(cc1)C)(=O)=O)Br
SPLASH splash10-0a4i-3900100000-f0e47d439f674eb06c5b
Source of Spectrum H1-38-2447-10
Synonyms 3,4,5-tribromo-1-[(4-methylphenyl)sulfonyl]-1H-pyrazole
Wiley ID 756568