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5-(4-Methoxyphenyl)-3-(methylsulfanyl)-1H-pyrazole
SpectraBase Compound ID LoZA4LNeueK
InChI InChI=1S/C11H12N2OS/c1-14-9-5-3-8(4-6-9)10-7-11(15-2)13-12-10/h3-7H,1-2H3,(H,12,13)
InChIKey MIISHAVOZVTBNS-UHFFFAOYSA-N
Mol Weight 220.29 g/mol
Molecular Formula C11H12N2OS
Exact Mass 220.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B28u1nTOfLM
Name 5-(4-Methoxyphenyl)-3-(methylsulfanyl)-1H-pyrazole
Alternate Name(s) 5-(4-Methoxyphenyl)-3-(methylthio)-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2OS
InChI InChI=1S/C11H12N2OS/c1-14-9-5-3-8(4-6-9)10-7-11(15-2)13-12-10/h3-7H,1-2H3,(H,12,13)
InChIKey MIISHAVOZVTBNS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201300070
Molecular Weight 220.290 g/mol
SMILES [nH]1nc(cc1-c1ccc(cc1)OC)SC
SPLASH splash10-00ui-8950000000-e9fd6b26b70a5c81e3e3
Source of Spectrum H-96-2243-2b
Wiley ID 1784641