SpectraBase Spectrum ID |
3Bufr5cd6hY |
Name |
1H-indole, 5-bromo-2,3-dihydro-1-(1-oxopropyl)-7-[[3-oxo-3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]sulfonyl]- |
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/C25H27BrF3N3O4S/c1-2-22(33)32-8-6-17-14-19(26)16-21(24(17)32)37(35,36)13-7-23(34)31-11-9-30(10-12-31)20-5-3-4-18(15-20)25(27,28)29/h3-5,14-16H,2,6-13H2,1H3 |
InChIKey |
QKKAMYHYJGDCIR-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_CB3_9000_8119 |
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: NMR/12258260 |