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4-BROM-1-TOSYLPYRAZOL
SpectraBase Compound ID 4dkJtO7i7FQ
InChI InChI=1S/C10H9BrN2O2S/c1-8-2-4-10(5-3-8)16(14,15)13-7-9(11)6-12-13/h2-7H,1H3
InChIKey XRKOINRPMVFMFN-UHFFFAOYSA-N
Mol Weight 301.16 g/mol
Molecular Formula C10H9BrN2O2S
Exact Mass 299.956812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yAMzS1hhCW
Name 4-bromanyl-1-(4-methylphenyl)sulfonyl-pyrazole
CAS Registry Number 116228-41-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9BrN2O2S
InChI InChI=1S/C10H9BrN2O2S/c1-8-2-4-10(5-3-8)16(14,15)13-7-9(11)6-12-13/h2-7H,1H3
InChIKey XRKOINRPMVFMFN-UHFFFAOYSA-N
Molecular Weight 301.158 g/mol
SMILES c1(S([n]2cc(Br)cn2)(=O)=O)ccc(cc1)C
SPLASH splash10-0006-9000000000-777834d7ee68fbbcfffc
Source of Spectrum AH-119-258-2
Synonyms 4-bromo-1-(4-methylphenyl)sulfonylpyrazole 4-bromo-1-(p-tolylsulfonyl)pyrazole 4-bromo-1-tosyl-pyrazole
Wiley ID 1302348