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1H-pyrazole-3-acetonitrile, 5-amino-4-cyano-alpha-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methylene]-1-(2-hydroxyethyl)-

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1H-pyrazole-3-acetonitrile, 5-amino-4-cyano-alpha-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methylene]-1-(2-hydroxyethyl)-
SpectraBase Compound ID C2mL8amJTQe
InChI InChI=1S/C24H22FN5O3/c1-2-32-22-12-17(5-8-21(22)33-15-16-3-6-19(25)7-4-16)11-18(13-26)23-20(14-27)24(28)30(29-23)9-10-31/h3-8,11-12,31H,2,9-10,15,28H2,1H3/b18-11+
InChIKey LHKWJOKUWLKUSU-WOJGMQOQSA-N
Mol Weight 447.47 g/mol
Molecular Formula C24H22FN5O3
Exact Mass 447.170668 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID wRyvidAjGU
Name 1H-pyrazole-3-acetonitrile, 5-amino-4-cyano-alpha-[[3-ethoxy-4-[(4-fluorophenyl)methoxy]phenyl]methylene]-1-(2-hydroxyethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.170667748 u
Formula C24H22FN5O3
InChI InChI=1S/C24H22FN5O3/c1-2-32-22-12-17(5-8-21(22)33-15-16-3-6-19(25)7-4-16)11-18(13-26)23-20(14-27)24(28)30(29-23)9-10-31/h3-8,11-12,31H,2,9-10,15,28H2,1H3/b18-11+
InChIKey LHKWJOKUWLKUSU-WOJGMQOQSA-N
Molecular Weight 447.470 g/mol
NMR Offset 16.1752
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1467
Solvent DMSO-d6
Source Vendor ID: ZI/8121937; Lab Info: SAD; Lab Number: SAD-1500080
Temperature 39.85 °C