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4-Benzylthio-1,3,5-trimethyl-pyrazole

View entire compound with spectra: 3 NMR, and 1 FTIR

4-Benzylthio-1,3,5-trimethyl-pyrazole
SpectraBase Compound ID HbQvMhiMK4b
InChI InChI=1S/C13H16N2S/c1-10-13(11(2)15(3)14-10)16-9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3
InChIKey UFPVAYGSCREGEZ-UHFFFAOYSA-N
Mol Weight 232.34 g/mol
Molecular Formula C13H16N2S
Exact Mass 232.10342 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IQjLmi03Urv
Name 4-(BENZYLTHIO)-1,3,5-TRIMETHYLPYRAZOLE
Source of Sample R. J. Alabaster & W. J. Barry, Merck Sharp & Dohme Research Laboratories, Hoddesdon, Hertfordshire, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2S
InChI InChI=1S/C13H16N2S/c1-10-13(11(2)15(3)14-10)16-9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3
InChIKey UFPVAYGSCREGEZ-UHFFFAOYSA-N
Melting Point 48-49.5C
Molecular Weight 232.345001
Synonyms PYRAZOLE, 4-/BENZYLTHIO/-1,3,5-TRI- METHYL-,
Technique CAPILLARY CELL: MELT (LIQUID PHASE)