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1-[3'-(t-Butyl)-4'-hydroxy-5'-methylbenzyl]-5-methyl-3-(trifluoromethyl)-pyrazole
SpectraBase Compound ID LiaAHFgiGA9
InChI InChI=1S/C17H21F3N2O/c1-10-6-12(8-13(15(10)23)16(3,4)5)9-22-11(2)7-14(21-22)17(18,19)20/h6-8,23H,9H2,1-5H3
InChIKey GVTCZUZNSBBKEK-UHFFFAOYSA-N
Mol Weight 326.36 g/mol
Molecular Formula C17H21F3N2O
Exact Mass 326.160598 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oUbq8ZQlE
Name 1-[3'-(t-Butyl)-4'-hydroxy-5'-methylbenzyl]-5-methyl-3-(trifluoromethyl)-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21F3N2O
InChI InChI=1S/C17H21F3N2O/c1-10-6-12(8-13(15(10)23)16(3,4)5)9-22-11(2)7-14(21-22)17(18,19)20/h6-8,23H,9H2,1-5H3
InChIKey GVTCZUZNSBBKEK-UHFFFAOYSA-N
Molecular Weight 326.363 g/mol
SMILES Oc1c(cc(C[n]2nc(cc2C)C(F)(F)F)cc1C(C)(C)C)C
SPLASH splash10-03di-0609000000-49147c18586be6280e92
Source of Spectrum QA-71-326-2
Synonyms 2-tert-Butyl-6-methyl-4-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}phenol
Wiley ID 1612113