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O-CIS-1-THYMYL-2,5-DIHYDROFUR-5-YLMETHYL(FLUOROMETHYL)PHOSPHONIC ACID
SpectraBase Compound ID 6cGcrJnQ3G
InChI InChI=1S/C11H14FN2O6P/c1-7-4-14(11(16)13-10(7)15)9-3-2-8(20-9)5-19-21(17,18)6-12/h2-4,8-9H,5-6H2,1H3,(H,17,18)(H,13,15,16)/t8-,9+/m0/s1
InChIKey BYXIFUYWUBDGTN-DTWKUNHWSA-N
Mol Weight 320.21 g/mol
Molecular Formula C11H14FN2O6P
Exact Mass 320.057351 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FeiVMP2FgSE
Name O-CIS-1-THYMYL-2,5-DIHYDROFUR-5-YLMETHYL(FLUOROMETHYL)PHOSPHONIC ACID
Comments , 31P-{1H}. NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14FN2O6P
InChI InChI=1S/C11H14FN2O6P/c1-7-4-14(11(16)13-10(7)15)9-3-2-8(20-9)5-19-21(17,18)6-12/h2-4,8-9H,5-6H2,1H3,(H,17,18)(H,13,15,16)/t8-,9+/m0/s1
InChIKey BYXIFUYWUBDGTN-DTWKUNHWSA-N
Instrument Name Varian XL-100
Literature Reference N.B.DYATKINA, M.V.YAS'KO, A.A.ARZUMANOV, A.A.KRAEVSKY, F.M.SEMCHENKO,O.G.EREMIN, B.I.MARTYNOV (1992) Bioorganich.Khim.(Russ. Lang.): v.18, N1, 100-105.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported