SpectraBase Spectrum ID |
I1jgccnkEoC |
Name |
1-[2-(4-chlorophenyl)-2-oxoethyl]-4-{[4-(ethoxycarbonyl)-5-methyl-1H-pyrazol-3-yl]carbonyl}pyridinium bromide |
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/C21H18ClN3O4.BrH/c1-3-29-21(28)18-13(2)23-24-19(18)20(27)15-8-10-25(11-9-15)12-17(26)14-4-6-16(22)7-5-14;/h4-11H,3,12H2,1-2H3;1H |
InChIKey |
OTZVEZCTSXHLAL-UHFFFAOYSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI-VK_18310_16565 |
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: 987/00004063; Labnumber: 987/00004063218849; VK_ID: VK-016570 |
Temperature |
318 °C |