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2-chloro-N-[3-chloro-4-(4-isobutyryl-1-piperazinyl)phenyl]nicotinamide
SpectraBase Compound ID A1ICQYVcEKR
InChI InChI=1S/C20H22Cl2N4O2/c1-13(2)20(28)26-10-8-25(9-11-26)17-6-5-14(12-16(17)21)24-19(27)15-4-3-7-23-18(15)22/h3-7,12-13H,8-11H2,1-2H3,(H,24,27)
InChIKey SAVQOPVMQTWEQH-UHFFFAOYSA-N
Mol Weight 421.33 g/mol
Molecular Formula C20H22Cl2N4O2
Exact Mass 420.111981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID nYml2Vnyvz
Name 2-chloro-N-[3-chloro-4-(4-isobutyryl-1-piperazinyl)phenyl]nicotinamide
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/C20H22Cl2N4O2/c1-13(2)20(28)26-10-8-25(9-11-26)17-6-5-14(12-16(17)21)24-19(27)15-4-3-7-23-18(15)22/h3-7,12-13H,8-11H2,1-2H3,(H,24,27)
InChIKey SAVQOPVMQTWEQH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30134
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: 1683914; SBI_ID: SBI-030138
Temperature 318 °C