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

*Links on SpectraBase are not permalinks.
[1,2,4]triazolo[4,3-c]quinazoline, 5-[[(4-chlorophenyl)methyl]thio]-3-(4-nitrophenyl)-
SpectraBase Compound ID B4atBBQ8tY
InChI InChI=1S/C22H14ClN5O2S/c23-16-9-5-14(6-10-16)13-31-22-24-19-4-2-1-3-18(19)21-26-25-20(27(21)22)15-7-11-17(12-8-15)28(29)30/h1-12H,13H2
InChIKey ZGWDIZJXPFOJMT-UHFFFAOYSA-N
Mol Weight 447.9 g/mol
Molecular Formula C22H14ClN5O2S
Exact Mass 447.055674 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 DiybEqZTeJo
Name [1,2,4]triazolo[4,3-c]quinazoline, 5-[[(4-chlorophenyl)methyl]thio]-3-(4-nitrophenyl)-
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/C22H14ClN5O2S/c23-16-9-5-14(6-10-16)13-31-22-24-19-4-2-1-3-18(19)21-26-25-20(27(21)22)15-7-11-17(12-8-15)28(29)30/h1-12H,13H2
InChIKey ZGWDIZJXPFOJMT-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6233
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: NMR/11308567