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N-(Methoxy-methyl-phosphinothioyl)-L-phenylalanine methyl ester

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N-(Methoxy-methyl-phosphinothioyl)-L-phenylalanine methyl ester
SpectraBase Compound ID 1issOvIF7vu
InChI InChI=1S/C12H18NO3PS/c1-15-12(14)11(13-17(3,18)16-2)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,13,18)
InChIKey KRKUNHSCEIHTTH-UHFFFAOYSA-N
Mol Weight 287.31 g/mol
Molecular Formula C12H18NO3PS
Exact Mass 287.074502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJzW7CnRQFm
Name N-(Methoxy-methyl-phosphinothioyl)-L-phenylalanine methyl ester
CAS Registry Number 84558-29-2
Comments ISOMER 2, LOW FIELD SHIFT VALUES,REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18NO3PS
InChI InChI=1S/C12H18NO3PS/c1-15-12(14)11(13-17(3,18)16-2)9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,13,18)
InChIKey KRKUNHSCEIHTTH-UHFFFAOYSA-N
Literature Reference N.E. Jacobsen, P.A. Bartlett, J. Am. Chem. Soc. 105, 1619 (1983).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3