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4-ETHOXYMETHOXYTHIOPHOSPHORYL-5-METHYL-4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONE(DIASTEREOMER MIXTURE)
SpectraBase Compound ID 5mJ7MDw25RX
InChI InChI=1S/C7H14N3O3PS/c1-4-13-14(15,12-3)10-5-8-9-7(11)6(10)2/h5-6H,4H2,1-3H3,(H,9,11)
InChIKey QDIBFHFJJCFAOC-UHFFFAOYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C7H14N3O3PS
Exact Mass 251.049349 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkWXOCWzeel
Name 4-ETHOXYMETHOXYTHIOPHOSPHORYL-5-METHYL-4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONE(DIASTEREOMER MIXTURE)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H14N3O3PS
InChI InChI=1S/C7H14N3O3PS/c1-4-13-14(15,12-3)10-5-8-9-7(11)6(10)2/h5-6H,4H2,1-3H3,(H,9,11)
InChIKey QDIBFHFJJCFAOC-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference ZH.Z.SAPOZHNIKOVA, A.F.PROKOF'EVA, V.N.VOLKOVA, V.V.NEGREBETSKY,L.A.POKROVSKAYA, N.N.MEL'NIKOV (1991) Zhurn.Obsch.Khim.(Russ. Lang.): v.61, N2,406-415.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6