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Cyanomethylphosphonic acid diethyl ester

View entire compound with spectra: 14 NMR, 7 FTIR, 1 Raman, 1 MS (GC), and 2 Near IR

Cyanomethylphosphonic acid diethyl ester
SpectraBase Compound ID BUmFCjzdSqO
InChI InChI=1S/C6H12NO3P/c1-3-9-11(8,6-5-7)10-4-2/h3-4,6H2,1-2H3
InChIKey KWMBADTWRIGGGG-UHFFFAOYSA-N
Mol Weight 177.14 g/mol
Molecular Formula C6H12NO3P
Exact Mass 177.05548 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EiaS7GoCkD
Name (CYANOMETHYL)PHOSPHONIC ACID, DIETHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 101-102C/0.4mm
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12NO3P
InChI InChI=1S/C6H12NO3P/c1-3-9-11(8,6-5-7)10-4-2/h3-4,6H2,1-2H3
InChIKey KWMBADTWRIGGGG-UHFFFAOYSA-N
Molecular Weight 177.14
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PHOSPHONIC ACID, /CYANOMETHYL/-, DIETHYL ESTER