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3-BENZOYL-4-PYRAZOLYL-PHOSPHONSAEUREDIISOPROPYLESTER

View entire compound with spectra: 2 NMR

3-BENZOYL-4-PYRAZOLYL-PHOSPHONSAEUREDIISOPROPYLESTER
SpectraBase Compound ID FFXZ9c5ZNAN
InChI InChI=1S/C16H21N2O4P/c1-11(2)21-23(20,22-12(3)4)14-10-17-18-15(14)16(19)13-8-6-5-7-9-13/h5-12H,1-4H3,(H,17,18)
InChIKey MJJSHXSUKXMMNM-UHFFFAOYSA-N
Mol Weight 336.33 g/mol
Molecular Formula C16H21N2O4P
Exact Mass 336.123894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BYGlx0iRjwK
Name 3-Benzoyl-4-pyrazolylphosphonic acid, diisopropyl ester
CAS Registry Number 91359-53-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H21N2O4P
InChI InChI=1S/C16H21N2O4P/c1-11(2)21-23(20,22-12(3)4)14-10-17-18-15(14)16(19)13-8-6-5-7-9-13/h5-12H,1-4H3,(H,17,18)
InChIKey MJJSHXSUKXMMNM-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference E. Oehler, E. Zbiral, Monatsh. Chem. 115, 493 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3