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Diethyl-1-(1,5-diphenylpyrazol-3-yl)-ethylphosphonate

View entire compound with spectra: 2 NMR

Diethyl-1-(1,5-diphenylpyrazol-3-yl)-ethylphosphonate
SpectraBase Compound ID E1NoG3IOzi8
InChI InChI=1S/C21H25N2O3P/c1-4-25-27(24,26-5-2)17(3)20-16-21(18-12-8-6-9-13-18)23(22-20)19-14-10-7-11-15-19/h6-17H,4-5H2,1-3H3
InChIKey RNYYCPSKTOJNDH-UHFFFAOYSA-N
Mol Weight 384.42 g/mol
Molecular Formula C21H25N2O3P
Exact Mass 384.16028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRHB8nLmFJF
Name Diethyl-1-(1,5-diphenylpyrazol-3-yl)-ethylphosphonate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.160279668 u
Formula C21H25N2O3P
InChI InChI=1S/C21H25N2O3P/c1-4-25-27(24,26-5-2)17(3)20-16-21(18-12-8-6-9-13-18)23(22-20)19-14-10-7-11-15-19/h6-17H,4-5H2,1-3H3
InChIKey RNYYCPSKTOJNDH-UHFFFAOYSA-N
Molecular Weight 384.416 g/mol
SMILES C=1(N(N=C(C1)C(P(=O)(OCC)OCC)C)C1=CC=CC=C1)C=1C=CC=CC1