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5-(CYANOMETHOXY)-2-NITROBENZYL-N,N-BIS-(2-CHLOROETHYL)-PHOSPHORODIAMIDATE

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5-(CYANOMETHOXY)-2-NITROBENZYL-N,N-BIS-(2-CHLOROETHYL)-PHOSPHORODIAMIDATE
SpectraBase Compound ID 41umTFCkntX
InChI InChI=1S/C13H17Cl2N4O5P/c14-3-6-18(7-4-15)25(17,22)24-10-11-9-12(23-8-5-16)1-2-13(11)19(20)21/h1-2,9H,3-4,6-8,10H2,(H2,17,22)
InChIKey HPYWYFPNKKDDNP-UHFFFAOYSA-N
Mol Weight 411.18 g/mol
Molecular Formula C13H17Cl2N4O5P
Exact Mass 410.031362 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6BnIMusGXNg
Name 5-(CYANOMETHOXY)-2-NITROBENZYL-N,N-BIS-(2-CHLOROETHYL)-PHOSPHORODIAMIDATE
Compound Number 10F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17Cl2N4O5P
InChI InChI=1S/C13H17Cl2N4O5P/c14-3-6-18(7-4-15)25(17,22)24-10-11-9-12(23-8-5-16)1-2-13(11)19(20)21/h1-2,9H,3-4,6-8,10H2,(H2,17,22)
InChIKey HPYWYFPNKKDDNP-UHFFFAOYSA-N
Literature Reference Author R.REINHARD,B.F.SCHMIDT
Literature Reference Citation J.ORG.CHEM.,63,2434(1998)
Literature Reference DOI 10.1021/jo961861m
Solvent CD3CN
Source File Reference UWSI28236