John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=ER4t7Efd8kd SpectraBase Spectrum ID=FSc8NCMSqFj

(accessed ).
DIETHYL-2-(6-CYANOHEXYL)-1,3-DIOXO-2,3,3A,4,7,7A-HEXAHYDRO-1H-ISOINDOLE-4-PHOSPHONATE
SpectraBase Compound ID ER4t7Efd8kd
InChI InChI=1S/C19H29N2O5P/c1-3-25-27(24,26-4-2)16-12-10-11-15-17(16)19(23)21(18(15)22)14-9-7-5-6-8-13-20/h10,12,15-17H,3-9,11,14H2,1-2H3/t15-,16+,17-/m0/s1
InChIKey SVIBGRRDKKVLJO-BBWFWOEESA-N
Mol Weight 396.42 g/mol
Molecular Formula C19H29N2O5P
Exact Mass 396.181411 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FSc8NCMSqFj
Name DIETHYL-2-(6-CYANOHEXYL)-1,3-DIOXO-2,3,3A,4,7,7A-HEXAHYDRO-1H-ISOINDOLE-4-PHOSPHONATE
Compound Number 5C
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H29N2O5P
InChI InChI=1S/C19H29N2O5P/c1-3-25-27(24,26-4-2)16-12-10-11-15-17(16)19(23)21(18(15)22)14-9-7-5-6-8-13-20/h10,12,15-17H,3-9,11,14H2,1-2H3/t15-,16+,17-/m0/s1
InChIKey SVIBGRRDKKVLJO-BBWFWOEESA-N
Literature Reference Author E.VILLEMIN,M.F.HERENT,J.MARCHAND-BRYNAERT
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6165(2012)
Literature Reference DOI 10.1002/ejoc.201200806
Solvent CDCl3
Source File Reference UWLU83934
SpectraBase Batch ID 8y32GpNLNqk