SpectraBase Spectrum ID |
DccANuGj33i |
Name |
1-(3-bromobenzyl)-4-({5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-3-isoxazolyl}carbonyl)piperazine |
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/C20H21BrN6O4/c1-14-18(13-26-12-17(10-22-26)27(29)30)19(23-31-14)20(28)25-7-5-24(6-8-25)11-15-3-2-4-16(21)9-15/h2-4,9-10,12H,5-8,11,13H2,1H3 |
InChIKey |
JWTMWHWRDUHUIA-UHFFFAOYSA-N |
NMR Offset |
15.449 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_32987 |
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: 1911859; SBI_ID: SBI-032991 |
Temperature |
308 °C |