For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 1-[3-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-4-(phenylmethyl)-
SpectraBase Compound ID 84DAVHZoFJE
InChI InChI=1S/C29H27FN6O2/c30-22-10-12-23(13-11-22)33-16-18-34(19-17-33)27(37)15-14-26-31-32-29-35(20-21-6-2-1-3-7-21)28(38)24-8-4-5-9-25(24)36(26)29/h1-13H,14-20H2
InChIKey XYCPEQIHMLIHMW-UHFFFAOYSA-N
Mol Weight 510.57 g/mol
Molecular Formula C29H27FN6O2
Exact Mass 510.217952 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JXhqcMGNvpG
Name [1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 1-[3-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-4-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.217952294 u
Formula C29H27FN6O2
InChI InChI=1S/C29H27FN6O2/c30-22-10-12-23(13-11-22)33-16-18-34(19-17-33)27(37)15-14-26-31-32-29-35(20-21-6-2-1-3-7-21)28(38)24-8-4-5-9-25(24)36(26)29/h1-13H,14-20H2
InChIKey XYCPEQIHMLIHMW-UHFFFAOYSA-N
Molecular Weight 510.573 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6552
Solvent DMSO-d6
Source Vendor ID: NMR/13289937