John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=11kaekaYAZ4 SpectraBase Spectrum ID=DE1I2cuU8Vv

(accessed ).
DIETHYL-2-(6-HYDROXYHEXYL)-1,3-DIOXO-2,3,3A,4,7,7A-HEXAHYDRO-1H-ISOINDOLE-4-PHOSPHONATE
SpectraBase Compound ID 11kaekaYAZ4
InChI InChI=1S/C18H30NO6P/c1-3-24-26(23,25-4-2)15-11-9-10-14-16(15)18(22)19(17(14)21)12-7-5-6-8-13-20/h9,11,14-16,20H,3-8,10,12-13H2,1-2H3/t14-,15+,16-/m0/s1
InChIKey UXAGVBDJRHZMAB-XHSDSOJGSA-N
Mol Weight 387.41 g/mol
Molecular Formula C18H30NO6P
Exact Mass 387.181076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DE1I2cuU8Vv
Name DIETHYL-2-(6-HYDROXYHEXYL)-1,3-DIOXO-2,3,3A,4,7,7A-HEXAHYDRO-1H-ISOINDOLE-4-PHOSPHONATE
Compound Number 5G
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30NO6P
InChI InChI=1S/C18H30NO6P/c1-3-24-26(23,25-4-2)15-11-9-10-14-16(15)18(22)19(17(14)21)12-7-5-6-8-13-20/h9,11,14-16,20H,3-8,10,12-13H2,1-2H3/t14-,15+,16-/m0/s1
InChIKey UXAGVBDJRHZMAB-XHSDSOJGSA-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
Molecular Weight 387.413 g/mol
Solvent CDCl3
Source File Reference UWLU83937
SpectraBase Batch ID DBBah0CoHxC