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N-[2-[(1-diethoxyphosphoryl-2,2,2-trifluoro-ethyl)amino]-2-keto-ethyl]carbamic acid benzyl ester
SpectraBase Compound ID I2PxxWVwYD1
InChI InChI=1S/C16H22F3N2O6P/c1-3-26-28(24,27-4-2)14(16(17,18)19)21-13(22)10-20-15(23)25-11-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3,(H,20,23)(H,21,22)
InChIKey WSKYNABTBZCPRD-UHFFFAOYSA-N
Mol Weight 426.33 g/mol
Molecular Formula C16H22F3N2O6P
Exact Mass 426.116758 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HcBrInDA1Pk
Name N-[2-[(1-diethoxyphosphoryl-2,2,2-trifluoro-ethyl)amino]-2-keto-ethyl]carbamic acid benzyl ester
Compound Number 4K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22F3N2O6P
InChI InChI=1S/C16H22F3N2O6P/c1-3-26-28(24,27-4-2)14(16(17,18)19)21-13(22)10-20-15(23)25-11-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3,(H,20,23)(H,21,22)
InChIKey WSKYNABTBZCPRD-UHFFFAOYSA-N
Literature Reference Author P.D.MEDINA,L.S.INGRASSIA,M.E.MULLIEZ
Literature Reference Citation J.ORG.CHEM.,68,8424(2003)
Literature Reference DOI 10.1021/jo034229j
Solvent DMSO-D6
Source File Reference UWVN21043