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N-(2,5,8-Trioxo-2,5,8-triethoxy-2,5,8-triphospha-3,6-diaza-9-oxa-undecyl)isoindole-1,3-dione
SpectraBase Compound ID 2isaTI7uzmh
InChI InChI=1S/C19H32N3O9P3/c1-5-28-32(25,21-14-34(27,30-7-3)31-8-4)13-20-33(26,29-6-2)15-22-18(23)16-11-9-10-12-17(16)19(22)24/h9-12H,5-8,13-15H2,1-4H3,(H,20,26)(H,21,25)
InChIKey JGGGZTCNSPXKDW-UHFFFAOYSA-N
Mol Weight 539.4 g/mol
Molecular Formula C19H32N3O9P3
Exact Mass 539.135141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3A4nNb40KFP
Name N-(2,5,8-Trioxo-2,5,8-triethoxy-2,5,8-triphospha-3,6-diaza-9-oxa-undecyl)isoindole-1,3-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 539.135140607 u
Formula C19H32N3O9P3
InChI InChI=1S/C19H32N3O9P3/c1-5-28-32(25,21-14-34(27,30-7-3)31-8-4)13-20-33(26,29-6-2)15-22-18(23)16-11-9-10-12-17(16)19(22)24/h9-12H,5-8,13-15H2,1-4H3,(H,20,26)(H,21,25)
InChIKey JGGGZTCNSPXKDW-UHFFFAOYSA-N
Molecular Weight 539.398 g/mol
SMILES C1=CC=CC2=C1C(=O)N(C2=O)CP(NCP(NCP(=O)(OCC)OCC)(OCC)=O)(OCC)=O