For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
O,O-DIETHYL-1-{3-[2,4,4-TRIS(TRIFLUOROMETHYL)-1,3,5-OXADIAZIN-6-YL]GUANIDINO}-1-METHYLETHYLPHOSPHONATE
SpectraBase Compound ID 6xOS1sub23z
InChI InChI=1S/C14H19F9N5O4P/c1-5-30-33(29,31-6-2)10(3,4)27-8(24)25-9-28-12(13(18,19)20,14(21,22)23)26-7(32-9)11(15,16)17/h5-6H2,1-4H3,(H3,24,25,27,28)
InChIKey YEPJXYSXGCJUTG-UHFFFAOYSA-N
Mol Weight 523.3 g/mol
Molecular Formula C14H19F9N5O4P
Exact Mass 523.103095 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8dIdOrHsYNa
Name O,O-DIETHYL-1-{3-[2,4,4-TRIS(TRIFLUOROMETHYL)-1,3,5-OXADIAZIN-6-YL]GUANIDINO}-1-METHYLETHYLPHOSPHONATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19F9N5O4P
InChI InChI=1S/C14H19F9N5O4P/c1-5-30-33(29,31-6-2)10(3,4)27-8(24)25-9-28-12(13(18,19)20,14(21,22)23)26-7(32-9)11(15,16)17/h5-6H2,1-4H3,(H3,24,25,27,28)
InChIKey YEPJXYSXGCJUTG-UHFFFAOYSA-N
Instrument Name Bruker CXP-200
Literature Reference A.YU.AKSINENKO, V.B.SOKOLOV, O.V.KORENCHENKO, A.N.CHEKHLOV, E.A.FOKIN,I.V.MARTYNOV (1989) Izv.Akad.Nauk SSSR(Russ. Lang.): N12, 2815-2819.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d