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1-[(4-Methylphenyl)sulfonyl]-4-nitro-1H-pyrazole
SpectraBase Compound ID G3o6XvUgQL0
InChI InChI=1S/C10H9N3O4S/c1-8-2-4-10(5-3-8)18(16,17)12-7-9(6-11-12)13(14)15/h2-7H,1H3
InChIKey UQXTZCMKWNNBMG-UHFFFAOYSA-N
Mol Weight 267.26 g/mol
Molecular Formula C10H9N3O4S
Exact Mass 267.031377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KNRmBfXIBx
Name 1-[(4-Methylphenyl)sulfonyl]-4-nitro-1H-pyrazole
CAS Registry Number 3994-49-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3O4S
InChI InChI=1S/C10H9N3O4S/c1-8-2-4-10(5-3-8)18(16,17)12-7-9(6-11-12)13(14)15/h2-7H,1H3
InChIKey UQXTZCMKWNNBMG-UHFFFAOYSA-N
Molecular Weight 267.259 g/mol
SMILES Cc1ccc(S([n]2cc(N(=O)=O)cn2)(=O)=O)cc1
SPLASH splash10-0006-9110000000-9f90ad757f51446c5e67
Source of Spectrum AD-0-2532-0
Synonyms 1-(4-Methylphenyl)sulfonyl-4-nitro-pyrazole 4-Nitro-1-(p-tolylsulfonyl)pyrazole 4-Nitro-1-tosyl-pyrazole Pyrazole, 1-(4-methylphenylsulfonyl)-4-nitro-
Wiley ID 1432161