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9-chloro-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole

View entire compound with spectra: 1 NMR

9-chloro-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole
SpectraBase Compound ID A7SjejFowmX
InChI InChI=1S/C20H18ClN5/c21-15-7-4-8-16-17(15)18-19(24-16)20(23-13-22-18)26-11-9-25(10-12-26)14-5-2-1-3-6-14/h1-8,13,24H,9-12H2
InChIKey PRQZCSRVLPOPCW-UHFFFAOYSA-N
Mol Weight 363.85 g/mol
Molecular Formula C20H18ClN5
Exact Mass 363.125073 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KbeDFAtJfag
Name 9-chloro-4-(4-phenyl-1-piperazinyl)-5H-pyrimido[5,4-b]indole
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/C20H18ClN5/c21-15-7-4-8-16-17(15)18-19(24-16)20(23-13-22-18)26-11-9-25(10-12-26)14-5-2-1-3-6-14/h1-8,13,24H,9-12H2
InChIKey PRQZCSRVLPOPCW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3955
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: E00029; Labnumber: SIMAK-02067; SBI_ID: SBI-003957
Temperature 318 °C