For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(trifluoromethyl)-, (6Z)-
SpectraBase Compound ID JX9vza0HkMn
InChI InChI=1S/C22H17F3N4O4S/c1-31-14-6-8-16(9-7-14)33-11-10-32-15-4-2-13(3-5-15)12-17-18(26)29-21(27-19(17)30)34-20(28-29)22(23,24)25/h2-9,12,26H,10-11H2,1H3/b17-12-,26-18?
InChIKey IDYJUBMVSUZKEC-HQFASYQYSA-N
Mol Weight 490.46 g/mol
Molecular Formula C22H17F3N4O4S
Exact Mass 490.092261 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Iasrs5DU8bz
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-6-[[4-[2-(4-methoxyphenoxy)ethoxy]phenyl]methylene]-2-(trifluoromethyl)-, (6Z)-
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/C22H17F3N4O4S/c1-31-14-6-8-16(9-7-14)33-11-10-32-15-4-2-13(3-5-15)12-17-18(26)29-21(27-19(17)30)34-20(28-29)22(23,24)25/h2-9,12,26H,10-11H2,1H3/b17-12-,26-18?
InChIKey IDYJUBMVSUZKEC-HQFASYQYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2602
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/11269276