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3,4,5-trimethyl-1-tosyl-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

3,4,5-trimethyl-1-tosyl-1H-pyrazole
SpectraBase Compound ID 4r0W7t3o5ky
InChI InChI=1S/C13H16N2O2S/c1-9-5-7-13(8-6-9)18(16,17)15-12(4)10(2)11(3)14-15/h5-8H,1-4H3
InChIKey ZHQFLLFBCHMUAN-UHFFFAOYSA-N
Mol Weight 264.34 g/mol
Molecular Formula C13H16N2O2S
Exact Mass 264.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VNtew3FOi
Name 3,4,5-trimethyl-1-tosyl-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2S
InChI InChI=1S/C13H16N2O2S/c1-9-5-7-13(8-6-9)18(16,17)15-12(4)10(2)11(3)14-15/h5-8H,1-4H3
InChIKey ZHQFLLFBCHMUAN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/aoc.4532
Molecular Weight 264.343 g/mol
SMILES Cc1[n](nc(C)c1C)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0udm-8940000000-a6ba2e41ac0a2cf8a427
Source of Spectrum AOC-32-SM12-3b
Wiley ID 1812492