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

*Links on SpectraBase are not permalinks.
8,9-dimethoxy-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
SpectraBase Compound ID 9hqDB630GK4
InChI InChI=1S/C29H28N6O3S/c1-37-24-17-22-23(18-25(24)38-2)30-29(35-28(22)31-27(32-35)20-9-5-3-6-10-20)39-19-26(36)34-15-13-33(14-16-34)21-11-7-4-8-12-21/h3-12,17-18H,13-16,19H2,1-2H3
InChIKey HZCJAUABXWEUIC-UHFFFAOYSA-N
Mol Weight 540.64 g/mol
Molecular Formula C29H28N6O3S
Exact Mass 540.19436 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 K8rzFcEnDZG
Name 8,9-dimethoxy-5-{[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfanyl}-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 540.194359957 u
Formula C29H28N6O3S
InChI InChI=1S/C29H28N6O3S/c1-37-24-17-22-23(18-25(24)38-2)30-29(35-28(22)31-27(32-35)20-9-5-3-6-10-20)39-19-26(36)34-15-13-33(14-16-34)21-11-7-4-8-12-21/h3-12,17-18H,13-16,19H2,1-2H3
InChIKey HZCJAUABXWEUIC-UHFFFAOYSA-N
Molecular Weight 540.642 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_7038
Solvent DMSO-d6
Source Vendor ID: NMR/12329522