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

*Links on SpectraBase are not permalinks.
[1,2,4]triazolo[4,3-c]quinazoline, 3-(4-nitrophenyl)-5-[[(3-nitrophenyl)methyl]thio]-
SpectraBase Compound ID COE6V69DlII
InChI InChI=1S/C22H14N6O4S/c29-27(30)16-10-8-15(9-11-16)20-24-25-21-18-6-1-2-7-19(18)23-22(26(20)21)33-13-14-4-3-5-17(12-14)28(31)32/h1-12H,13H2
InChIKey FBUVDYWYVSYLMY-UHFFFAOYSA-N
Mol Weight 458.45 g/mol
Molecular Formula C22H14N6O4S
Exact Mass 458.079724 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 5bJSb8ChHgR
Name [1,2,4]triazolo[4,3-c]quinazoline, 3-(4-nitrophenyl)-5-[[(3-nitrophenyl)methyl]thio]-
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/C22H14N6O4S/c29-27(30)16-10-8-15(9-11-16)20-24-25-21-18-6-1-2-7-19(18)23-22(26(20)21)33-13-14-4-3-5-17(12-14)28(31)32/h1-12H,13H2
InChIKey FBUVDYWYVSYLMY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6234
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/11308568