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1-[(4-iodobenzene)sulfonyl]-3-methyl-1H-pyrazole
SpectraBase Compound ID D6pDI1ECwda
InChI InChI=1S/C10H9IN2O2S/c1-8-6-7-13(12-8)16(14,15)10-4-2-9(11)3-5-10/h2-7H,1H3
InChIKey NUUFLLMDPVACAH-UHFFFAOYSA-N
Mol Weight 348.16 g/mol
Molecular Formula C10H9IN2O2S
Exact Mass 347.942944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mEuG154iZh
Name 1-[(4-iodobenzene)sulfonyl]-3-methyl-1H-pyrazole
Alternate Name(s) 1H-Pyrazole, 1-[(4-iodophenyl)sulfonyl]-3-methyl- 1-(4-iodophenyl)sulfonyl-3-methylpyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9IN2O2S
InChI InChI=1S/C10H9IN2O2S/c1-8-6-7-13(12-8)16(14,15)10-4-2-9(11)3-5-10/h2-7H,1H3
InChIKey NUUFLLMDPVACAH-UHFFFAOYSA-N
Molecular Weight 348.158 g/mol
SMILES Cc1n[n](S(c2ccc(cc2)I)(=O)=O)cc1
SPLASH splash10-0ufr-9120000000-dbc40fa304b84f11d076
Source of Spectrum IY-2-5123-7
Wiley ID 1659220