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pyridinium, 1-[5-cyano-4-(4-fluorophenyl)-2,6-dioxo-3-piperidinyl]-,chloride
SpectraBase Compound ID 4zwWedcpq7n
InChI InChI=1S/C17H12FN3O2.ClH/c18-12-6-4-11(5-7-12)14-13(10-19)16(22)20-17(23)15(14)21-8-2-1-3-9-21;/h1-9,13-15H;1H
InChIKey UHPNNMKUGGOWIZ-UHFFFAOYSA-N
Mol Weight 345.76 g/mol
Molecular Formula C17H13ClFN3O2
Exact Mass 345.068033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J3IZdlCIoJc
Name pyridinium, 1-[5-cyano-4-(4-fluorophenyl)-2,6-dioxo-3-piperidinyl]-,chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.068032532 u
Formula C17H13ClFN3O2
InChI InChI=1S/C17H12FN3O2.ClH/c18-12-6-4-11(5-7-12)14-13(10-19)16(22)20-17(23)15(14)21-8-2-1-3-9-21;/h1-9,13-15H;1H
InChIKey UHPNNMKUGGOWIZ-UHFFFAOYSA-N
Molecular Weight 345.761 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11651
Solvent DMSO-d6
Source Vendor ID: NMR/10271269; Lab Info: KOR; Lab Number: KOR-KO00075
Temperature 29.85 °C