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DIETHYL-(1,1A,3,3A,4,7)-HEXAHYDRO-2-(5-ETHOXYPHOSPHONOPENTYL)-2H-ISOINDOL-4-PHOSPHONATE-1,3-DIONE
SpectraBase Compound ID DqgthGe3zJ4
InChI InChI=1S/C21H37NO9P2/c1-5-27-32(25,28-6-2)18-14-12-13-17-19(18)21(24)22(20(17)23)15-10-9-11-16-31-33(26,29-7-3)30-8-4/h12,14,17-19H,5-11,13,15-16H2,1-4H3/t17-,18+,19-/m0/s1
InChIKey QIDUYVAFQFKGSJ-OTWHNJEPSA-N
Mol Weight 509.5 g/mol
Molecular Formula C21H37NO9P2
Exact Mass 509.194356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4v4FNcbj08
Name DIETHYL-(1,1A,3,3A,4,7)-HEXAHYDRO-2-(5-ETHOXYPHOSPHONOPENTYL)-2H-ISOINDOL-4-PHOSPHONATE-1,3-DIONE
Compound Number 9'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H37NO9P2
InChI InChI=1S/C21H37NO9P2/c1-5-27-32(25,28-6-2)18-14-12-13-17-19(18)21(24)22(20(17)23)15-10-9-11-16-31-33(26,29-7-3)30-8-4/h12,14,17-19H,5-11,13,15-16H2,1-4H3/t17-,18+,19-/m0/s1
InChIKey QIDUYVAFQFKGSJ-OTWHNJEPSA-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 509.474 g/mol
Solvent CDCl3
Source File Reference UWLU83976