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1-Carboxymethyl-5-trifluoromethyl-5-hydroxy-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID J9soRpdmkqM
InChI InChI=1S/C6H7F3N2O3/c1-14-4(12)11-5(13,2-3-10-11)6(7,8)9/h3,13H,2H2,1H3
InChIKey ZRIILMVCIJFKBS-UHFFFAOYSA-N
Mol Weight 212.13 g/mol
Molecular Formula C6H7F3N2O3
Exact Mass 212.040877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNR53ikwlgl
Name 1-CARBOXYMETHYL-5-TRIFLUOROMETHYL-5-HYDROXY-4,5-DIHYDRO-1H-PYRAZOLE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H7F3N2O3
InChI InChI=1S/C6H7F3N2O3/c1-14-4(12)11-5(13,2-3-10-11)6(7,8)9/h3,13H,2H2,1H3
InChIKey ZRIILMVCIJFKBS-UHFFFAOYSA-N
Literature Reference Author L.BURIOL,C.P.FRIZZO,M.R.B.MARZARI,D.N.MOREIRA,L.D.T.PROLA,N. ZANATTA,H.G.BONACORS
Literature Reference Citation J.BRAZ.CHEM.SOC.,21,1037(2010)
Literature Reference DOI 10.1590/s0103-50532010000600012
Molecular Weight 212.128 g/mol
Source File Reference UWBT5864