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4-Chlorophenylaminomethylen-diphosphonic-acid-tetraethylester

View entire compound with spectra: 2 NMR

4-Chlorophenylaminomethylen-diphosphonic-acid-tetraethylester
SpectraBase Compound ID CykU1QZuVk0
InChI InChI=1S/C15H26ClNO6P2/c1-5-20-24(18,21-6-2)15(25(19,22-7-3)23-8-4)17-14-11-9-13(16)10-12-14/h9-12,15,17H,5-8H2,1-4H3
InChIKey FBEKGGMTMVTZPH-UHFFFAOYSA-N
Mol Weight 413.77 g/mol
Molecular Formula C15H26ClNO6P2
Exact Mass 413.092389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ehRopMDBlY
Name 4-Chlorophenylaminomethylen-diphosphonic-acid-tetraethylester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.092389251 u
Formula C15H26ClNO6P2
InChI InChI=1S/C15H26ClNO6P2/c1-5-20-24(18,21-6-2)15(25(19,22-7-3)23-8-4)17-14-11-9-13(16)10-12-14/h9-12,15,17H,5-8H2,1-4H3
InChIKey FBEKGGMTMVTZPH-UHFFFAOYSA-N
Molecular Weight 413.775 g/mol
SMILES C(OP(=O)(OCC)C(P(=O)(OCC)OCC)NC1=CC=C(Cl)C=C1)C