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1-[3',5'-bis(t-Butyl)-4'-hydroxybenzyl]-3,5-bis(trifluoromethyl)-pyrazole
SpectraBase Compound ID FU1Xv12fptQ
InChI InChI=1S/C20H24F6N2O/c1-17(2,3)12-7-11(8-13(16(12)29)18(4,5)6)10-28-15(20(24,25)26)9-14(27-28)19(21,22)23/h7-9,29H,10H2,1-6H3
InChIKey LCSWRDDJLNHAOZ-UHFFFAOYSA-N
Mol Weight 422.42 g/mol
Molecular Formula C20H24F6N2O
Exact Mass 422.179282 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID x2EmIX6kxk
Name 1-[3',5'-bis(t-Butyl)-4'-hydroxybenzyl]-3,5-bis(trifluoromethyl)-pyrazole
Alternate Name(s) 4-{[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-2,6-ditert-butylphenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24F6N2O
InChI InChI=1S/C20H24F6N2O/c1-17(2,3)12-7-11(8-13(16(12)29)18(4,5)6)10-28-15(20(24,25)26)9-14(27-28)19(21,22)23/h7-9,29H,10H2,1-6H3
InChIKey LCSWRDDJLNHAOZ-UHFFFAOYSA-N
Molecular Weight 422.415 g/mol
SMILES Oc1c(cc(C[n]2c(cc(C(F)(F)F)n2)C(F)(F)F)cc1C(C)(C)C)C(C)(C)C
SPLASH splash10-0a4i-0010900000-498d6c16f0d9f04335ea
Source of Spectrum QA-71-325-2
Wiley ID 1612116