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6-[[(4-NITROBENZYL)-(4-NITROPHENOXY)-PHOSPHORYL]-OXY]-HEXANOIC-ACID
SpectraBase Compound ID 1sUiozEFr8e
InChI InChI=1S/C19H21N2O9P/c22-19(23)4-2-1-3-13-29-31(28,14-15-5-7-16(8-6-15)20(24)25)30-18-11-9-17(10-12-18)21(26)27/h5-12H,1-4,13-14H2,(H,22,23)
InChIKey XWFOGHTVRZIGLF-UHFFFAOYSA-N
Mol Weight 452.36 g/mol
Molecular Formula C19H21N2O9P
Exact Mass 452.098467 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BANihOT8PYx
Name 6-[[(4-NITROBENZYL)-(4-NITROPHENOXY)-PHOSPHORYL]-OXY]-HEXANOIC-ACID
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21N2O9P
InChI InChI=1S/C19H21N2O9P/c22-19(23)4-2-1-3-13-29-31(28,14-15-5-7-16(8-6-15)20(24)25)30-18-11-9-17(10-12-18)21(26)27/h5-12H,1-4,13-14H2,(H,22,23)
InChIKey XWFOGHTVRZIGLF-UHFFFAOYSA-N
Literature Reference Author G.HUM,K.WOOLER,J.LEE,S.D.TAYLOR
Literature Reference Citation CAN.J.CHEM.,78,642(2000)
Literature Reference DOI 10.1139/cjc-78-5-642
Solvent CDCl3
Source File Reference UWPA1040