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4(3H)-quinazolinone, 3-(3,5-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-6-nitro-
SpectraBase Compound ID CPTAX2ySHJN
InChI InChI=1S/C27H26FN5O5/c1-37-22-13-21(14-23(16-22)38-2)32-26(29-25-8-7-20(33(35)36)15-24(25)27(32)34)17-30-9-11-31(12-10-30)19-5-3-18(28)4-6-19/h3-8,13-16H,9-12,17H2,1-2H3
InChIKey ZZOVMEZJGSSBHQ-UHFFFAOYSA-N
Mol Weight 519.53 g/mol
Molecular Formula C27H26FN5O5
Exact Mass 519.191797 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I1UzTwLqDMZ
Name 4(3H)-quinazolinone, 3-(3,5-dimethoxyphenyl)-2-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-6-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 519.191797115 u
Formula C27H26FN5O5
InChI InChI=1S/C27H26FN5O5/c1-37-22-13-21(14-23(16-22)38-2)32-26(29-25-8-7-20(33(35)36)15-24(25)27(32)34)17-30-9-11-31(12-10-30)19-5-3-18(28)4-6-19/h3-8,13-16H,9-12,17H2,1-2H3
InChIKey ZZOVMEZJGSSBHQ-UHFFFAOYSA-N
Molecular Weight 519.533 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7880
Solvent DMSO-d6
Source Vendor ID: NMR/13308745