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4-[4-(2,5-dimethylphenyl)-1-piperazinyl]-8-fluoro-5H-pyrimido[5,4-b]indole
SpectraBase Compound ID DF5OWNBn0Zm
InChI InChI=1S/C22H22FN5/c1-14-3-4-15(2)19(11-14)27-7-9-28(10-8-27)22-21-20(24-13-25-22)17-12-16(23)5-6-18(17)26-21/h3-6,11-13,26H,7-10H2,1-2H3
InChIKey QWYHGNPRLOMDMN-UHFFFAOYSA-N
Mol Weight 375.45 g/mol
Molecular Formula C22H22FN5
Exact Mass 375.185924 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 30ie3rk6Jph
Name 4-[4-(2,5-dimethylphenyl)-1-piperazinyl]-8-fluoro-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/C22H22FN5/c1-14-3-4-15(2)19(11-14)27-7-9-28(10-8-27)22-21-20(24-13-25-22)17-12-16(23)5-6-18(17)26-21/h3-6,11-13,26H,7-10H2,1-2H3
InChIKey QWYHGNPRLOMDMN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21806
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: D55772; Labnumber: Simak-01676; SBI_ID: SBI-021810
Temperature 315 °C