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4-AMINO-7-METHYLMERCAPTO-[1,2,4]-TRIAZOLO-[3,2-C]-[1,2,4]-TRIAZIN-3-YL-PHOSPHONIC-ACID-DIISOPROPYLESTER
SpectraBase Compound ID JsUkbWOcSi5
InChI InChI=1S/C11H19N6O3PS/c1-6(2)19-21(18,20-7(3)4)9-8(12)17-10(15-14-9)13-11(16-17)22-5/h6-7H,12H2,1-5H3
InChIKey VULYATZMGKSTFY-UHFFFAOYSA-N
Mol Weight 346.35 g/mol
Molecular Formula C11H19N6O3PS
Exact Mass 346.097697 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXpuY1oKACM
Name 4-AMINO-7-METHYLMERCAPTO-[1,2,4]-TRIAZOLO-[3,2-C]-[1,2,4]-TRIAZIN-3-YL-PHOSPHONIC-ACID-DIISOPROPYLESTER
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H19N6O3PS
InChI InChI=1S/C11H19N6O3PS/c1-6(2)19-21(18,20-7(3)4)9-8(12)17-10(15-14-9)13-11(16-17)22-5/h6-7H,12H2,1-5H3
InChIKey VULYATZMGKSTFY-UHFFFAOYSA-N
Literature Reference Author T.ANKENBRAND,R.NEIDLEIN
Literature Reference Citation HETEROCYCLES,51,513(1999)
Literature Reference DOI 10.3987/COM-98-8385
Solvent CDCl3
Source File Reference UWRU2586