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3-(4-{[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]carbonyl}phenyl)-2H-chromen-2-one
SpectraBase Compound ID KdQYeyFIKUW
InChI InChI=1S/C26H20ClN3O5/c27-20-9-10-22(23(16-20)30(33)34)28-11-13-29(14-12-28)25(31)18-7-5-17(6-8-18)21-15-19-3-1-2-4-24(19)35-26(21)32/h1-10,15-16H,11-14H2
InChIKey JSIUIRIMMQFPTA-UHFFFAOYSA-N
Mol Weight 489.92 g/mol
Molecular Formula C26H20ClN3O5
Exact Mass 489.109148 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K21YeR19RMO
Name 3-(4-{[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]carbonyl}phenyl)-2H-chromen-2-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H20ClN3O5/c27-20-9-10-22(23(16-20)30(33)34)28-11-13-29(14-12-28)25(31)18-7-5-17(6-8-18)21-15-19-3-1-2-4-24(19)35-26(21)32/h1-10,15-16H,11-14H2
InChIKey JSIUIRIMMQFPTA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8525
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: E12787; Labnumber: SPMOSE-0435; SBI_ID: SBI-008528
Temperature 318 °C