SpectraBase Spectrum ID |
3fYPsaeTTkj |
Name |
1-{4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoyl}-4-(ethylsulfonyl)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/C17H20ClN5O5S/c1-2-29(27,28)22-9-7-20(8-10-22)17(24)14-5-3-13(4-6-14)11-21-12-15(18)16(19-21)23(25)26/h3-6,12H,2,7-11H2,1H3 |
InChIKey |
AQDCMXURPFIADS-UHFFFAOYSA-N |
NMR Offset |
15.449 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_30112 |
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: 1669959; SBI_ID: SBI-030116 |
Temperature |
308 °C |