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guanidine, N-(2,4-difluorophenyl)-N'-(4,6-dimethyl-2-pyrimidinyl)-N''-[(E)-(4-fluorophenyl)oxomethyl]-
SpectraBase Compound ID 5fhzQbTysl6
InChI InChI=1S/C20H16F3N5O/c1-11-9-12(2)25-19(24-11)28-20(26-17-8-7-15(22)10-16(17)23)27-18(29)13-3-5-14(21)6-4-13/h3-10H,1-2H3,(H2,24,25,26,27,28,29)
InChIKey UVLJLRYPQIRTOQ-UHFFFAOYSA-N
Mol Weight 399.38 g/mol
Molecular Formula C20H16F3N5O
Exact Mass 399.130695 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9R7dvHNOGlY
Name guanidine, N-(2,4-difluorophenyl)-N'-(4,6-dimethyl-2-pyrimidinyl)-N''-[(E)-(4-fluorophenyl)oxomethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.130694643 u
Formula C20H16F3N5O
InChI InChI=1S/C20H16F3N5O/c1-11-9-12(2)25-19(24-11)28-20(26-17-8-7-15(22)10-16(17)23)27-18(29)13-3-5-14(21)6-4-13/h3-10H,1-2H3,(H2,24,25,26,27,28,29)
InChIKey UVLJLRYPQIRTOQ-UHFFFAOYSA-N
Molecular Weight 399.377 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13502
Solvent DMSO-d6
Source Vendor ID: ZI/10022629; Lab Info: VGY; Lab Number: VGY-0200087