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3,5-Dimethyl-1-tosyl-1H-pyrazole

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3,5-Dimethyl-1-tosyl-1H-pyrazole
SpectraBase Compound ID EMlcSQSDtG9
InChI InChI=1S/C12H14N2O2S/c1-9-4-6-12(7-5-9)17(15,16)14-11(3)8-10(2)13-14/h4-8H,1-3H3
InChIKey XEBCPVLMBKAGCP-UHFFFAOYSA-N
Mol Weight 250.32 g/mol
Molecular Formula C12H14N2O2S
Exact Mass 250.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YnzDMCTVWp
Name 3,5-Dimethyl-1-tosyl-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2S
InChI InChI=1S/C12H14N2O2S/c1-9-4-6-12(7-5-9)17(15,16)14-11(3)8-10(2)13-14/h4-8H,1-3H3
InChIKey XEBCPVLMBKAGCP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/aoc.4532
Molecular Weight 250.316 g/mol
SMILES Cc1[n](nc(C)c1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-000l-7900000000-806799817f14b1045778
Source of Spectrum AOC-32-SM11-3a
Wiley ID 1812491