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4(3H)-quinazolinone, 3-(2-fluorophenyl)-2-[[3-methyl-4-(4-methylphenyl)-1-piperazinyl]methyl]-6-nitro-
SpectraBase Compound ID GWWSDWc3mZx
InChI InChI=1S/C27H26FN5O3/c1-18-7-9-20(10-8-18)31-14-13-30(16-19(31)2)17-26-29-24-12-11-21(33(35)36)15-22(24)27(34)32(26)25-6-4-3-5-23(25)28/h3-12,15,19H,13-14,16-17H2,1-2H3
InChIKey QOHWFVZRDWZMBT-UHFFFAOYSA-N
Mol Weight 487.54 g/mol
Molecular Formula C27H26FN5O3
Exact Mass 487.201968 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ATjjvcxHreg
Name 4(3H)-quinazolinone, 3-(2-fluorophenyl)-2-[[3-methyl-4-(4-methylphenyl)-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 487.201967877 u
Formula C27H26FN5O3
InChI InChI=1S/C27H26FN5O3/c1-18-7-9-20(10-8-18)31-14-13-30(16-19(31)2)17-26-29-24-12-11-21(33(35)36)15-22(24)27(34)32(26)25-6-4-3-5-23(25)28/h3-12,15,19H,13-14,16-17H2,1-2H3
InChIKey QOHWFVZRDWZMBT-UHFFFAOYSA-N
Molecular Weight 487.535 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2289
Solvent DMSO-d6
Source Vendor ID: NMR/13268562