SpectraBase Spectrum ID |
Khl47zAZlQJ |
Name |
1-benzyl-4-{4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoyl}piperazin-1-ium |
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/C22H23N5O3/c28-22(25-14-12-24(13-15-25)16-18-4-2-1-3-5-18)20-8-6-19(7-9-20)17-26-11-10-21(23-26)27(29)30/h1-11H,12-17H2/p+1 |
InChIKey |
MZGXDQUNEIZAOD-UHFFFAOYSA-O |
NMR Offset |
14.9921 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_5788 |
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: UZI/8174019; UBI_ID: UBI-005790 |
Temperature |
308 °C |