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1-(TERT.-BUTYL)-3-PHENYL-4-TRIFLUOROACETYLPYRAZOLE
SpectraBase Compound ID FIMRubJ6Ljl
InChI InChI=1S/C16H17F3N2O/c1-10-5-7-11(8-6-10)13-12(14(22)16(17,18)19)9-21(20-13)15(2,3)4/h5-9H,1-4H3
InChIKey SVXQTBZGJLMITJ-UHFFFAOYSA-N
Mol Weight 310.32 g/mol
Molecular Formula C16H17F3N2O
Exact Mass 310.129298 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUsJSRsWUd
Name 1-(TERT.-BUTYL)-3-PHENYL-4-TRIFLUOROACETYLPYRAZOLE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17F3N2O
InChI InChI=1S/C16H17F3N2O/c1-10-5-7-11(8-6-10)13-12(14(22)16(17,18)19)9-21(20-13)15(2,3)4/h5-9H,1-4H3
InChIKey SVXQTBZGJLMITJ-UHFFFAOYSA-N
Literature Reference Author Y.KAMITORI,M.HOJO,R.MASUDA,M.FUJISHIRO,I.NAKAMURA,K.YAMAMOTO
Literature Reference Citation J.HETCYCL.CHEM.,30,389(1993)
Literature Reference DOI 10.1002/jhet.5570300217
Molecular Weight 310.319 g/mol
Solvent CDCl3
Source File Reference UWPB239