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N-(Hydroxy-methyl-phosphinothioyl)-L-phenylalanine methyl ester anion
SpectraBase Compound ID 8tjB1KrIPJY
InChI InChI=1S/C11H16NO3PS/c1-15-11(13)10(12-16(2,14)17)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H2,12,14,17)/p-1
InChIKey AFWXNQHVOIGQLQ-UHFFFAOYSA-M
Mol Weight 272.28 g/mol
Molecular Formula C11H15NO3PS
Exact Mass 272.051027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GTQsBIxVNFP
Name N-(Hydroxy-methyl-phosphinothioyl)-L-phenylalanine methyl ester anion
CAS Registry Number 84558-34-9
Comments SODIUM SALT ISOMER 1
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Formula C11H15NO3PS
InChI InChI=1S/C11H16NO3PS/c1-15-11(13)10(12-16(2,14)17)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H2,12,14,17)/p-1
InChIKey AFWXNQHVOIGQLQ-UHFFFAOYSA-M
Literature Reference N.E. Jacobsen, P.A. Bartlett, J. Am. Chem. Soc. 105, 1619 (1983).
NMR Standard CD3OD
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD