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1,3-Dimethyl-5-methoxy-4-(phenylsulfinylmethyl)-1H-pyrazole
SpectraBase Compound ID 1C9BJKSQd0y
InChI InChI=1S/C13H16N2O2S/c1-10-12(13(17-3)15(2)14-10)9-18(16)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey JPSACIBXOBXXGH-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 71cOKoSS4eB
Name 1,3-Dimethyl-5-methoxy-4-(phenylsulfinylmethyl)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2S
InChI InChI=1S/C13H16N2O2S/c1-10-12(13(17-3)15(2)14-10)9-18(16)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey JPSACIBXOBXXGH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200900729
Molecular Weight 264.343 g/mol
SMILES c1(n[n](C)c(OC)c1CS(c1ccccc1)=O)C
SPLASH splash10-000i-0910000000-47c51eaf3442e31ac169
Source of Spectrum ASC-352-309/SM6-1b
Synonyms 5-Methoxy-1,3-dimethyl-4-((phenylsulfinyl)methyl)-1H-pyrazole
Wiley ID 1764232