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

*Links on SpectraBase are not permalinks.
4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
SpectraBase Compound ID IlO3wWxSQk0
InChI InChI=1S/C16H17F3N6O2S/c17-16(18,19)14-22-23-15(28-14)21-12(26)4-5-13(27)25-9-7-24(8-10-25)11-3-1-2-6-20-11/h1-3,6H,4-5,7-10H2,(H,21,23,26)
InChIKey GJGGJRVJRKQQDU-UHFFFAOYSA-N
Mol Weight 414.41 g/mol
Molecular Formula C16H17F3N6O2S
Exact Mass 414.108579 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 EXN1OMqrk0u
Name 4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
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/C16H17F3N6O2S/c17-16(18,19)14-22-23-15(28-14)21-12(26)4-5-13(27)25-9-7-24(8-10-25)11-3-1-2-6-20-11/h1-3,6H,4-5,7-10H2,(H,21,23,26)
InChIKey GJGGJRVJRKQQDU-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11567
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: E07178; Labnumber: GRESKO-7676; SBI_ID: SBI-011570
Temperature 306 °C