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

*Links on SpectraBase are not permalinks.
[1,2,4]triazolo[1,5-c]quinazoline, 2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[[(4-nitrophenyl)methyl]thio]-
SpectraBase Compound ID IlO7OLsNUvK
InChI InChI=1S/C23H21N7O2S/c1-14-18(15(2)27-26-14)11-12-21-25-22-19-5-3-4-6-20(19)24-23(29(22)28-21)33-13-16-7-9-17(10-8-16)30(31)32/h3-10H,11-13H2,1-2H3,(H,26,27)
InChIKey IMTWETYZYFHSJM-UHFFFAOYSA-N
Mol Weight 459.53 g/mol
Molecular Formula C23H21N7O2S
Exact Mass 459.147744 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 KknASjVPfqK
Name [1,2,4]triazolo[1,5-c]quinazoline, 2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-5-[[(4-nitrophenyl)methyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.147744116 u
Formula C23H21N7O2S
InChI InChI=1S/C23H21N7O2S/c1-14-18(15(2)27-26-14)11-12-21-25-22-19-5-3-4-6-20(19)24-23(29(22)28-21)33-13-16-7-9-17(10-8-16)30(31)32/h3-10H,11-13H2,1-2H3,(H,26,27)
InChIKey IMTWETYZYFHSJM-UHFFFAOYSA-N
Molecular Weight 459.528 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4240
Solvent DMSO-d6
Source Vendor ID: NMR/13279765