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1-(1-METHOXYCARBONYLETHOXY)-5,5-BIS(TRIFLUOROMETHYL)-DELTA2-TRIAZOLINE-1,2,3
SpectraBase Compound ID 5KCdKzGR5JO
InChI InChI=1S/C8H9F6N3O3/c1-4(5(18)19-2)20-17-6(3-15-16-17,7(9,10)11)8(12,13)14/h4H,3H2,1-2H3
InChIKey KUPHYSRUZAGEIA-UHFFFAOYSA-N
Mol Weight 309.17 g/mol
Molecular Formula C8H9F6N3O3
Exact Mass 309.05481 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JNDggI6Kwwa
Name 1-(1-METHOXYCARBONYLETHOXY)-5,5-BIS(TRIFLUOROMETHYL)-DELTA2-TRIAZOLINE-1,2,3
Comments C=5 MOLAR %. MAY BE BS-487C (TESLA). SCALE INVERTED
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C8H9F6N3O3
InChI InChI=1S/C8H9F6N3O3/c1-4(5(18)19-2)20-17-6(3-15-16-17,7(9,10)11)8(12,13)14/h4H,3H2,1-2H3
InChIKey KUPHYSRUZAGEIA-UHFFFAOYSA-N
Instrument Name Jeol C-60 HL
Literature Reference R.G.KOSTYANOVSKY, A.V.PROSYANIK, A.I.MISCHENKO, N.L.ZAICHENKO, I.I.CHERVIN,V.I.MARKOV (1980) Izv.Akad.Nauk SSSR(Russ. Lang.): N4, 882-888.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl