SpectraBase Spectrum ID |
IBVR5NjJo6w |
Name |
1-[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]-4-[(2E)-3-(2-fluorophenyl)-2-propenoyl]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/C22H17ClFN3O4S/c23-20-16-7-6-15(27(30)31)13-18(16)32-21(20)22(29)26-11-9-25(10-12-26)19(28)8-5-14-3-1-2-4-17(14)24/h1-8,13H,9-12H2/b8-5+ |
InChIKey |
BEPAXBRZUKSDIU-VMPITWQZSA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UZI_26187_6914 |
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/1267375; Labnumber: COL3711; UZI_ID: UZI-006916 |
Synonyms |
1-[(3-chloro-6-nitro-1-benzothien-2-yl)carbonyl]-4-[3-(2-fluorophenyl)-2-propenoyl]piperazine |
Temperature |
318 °C |