SpectraBase Spectrum ID |
B17JUEJl8tc |
Name |
3-isothiazolecarboxamide, 4-[(1,3-benzodioxol-5-ylmethyl)amino]-N-(4-fluorophenyl)- |
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/C18H14FN3O3S/c19-12-2-4-13(5-3-12)21-18(23)17-14(9-26-22-17)20-8-11-1-6-15-16(7-11)25-10-24-15/h1-7,9,20H,8,10H2,(H,21,23) |
InChIKey |
LFCZGKMTJOZORL-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7529_6441 |
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/18251494; Labnumber: L17-0000031 |