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

*Links on SpectraBase are not permalinks.
N-(2-bromo-4,6-difluorophenyl)-2-{[4-(2-furylmethyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID Jo387yPng6b
InChI InChI=1S/C22H17BrF2N4O2S/c1-13-4-6-14(7-5-13)21-27-28-22(29(21)11-16-3-2-8-31-16)32-12-19(30)26-20-17(23)9-15(24)10-18(20)25/h2-10H,11-12H2,1H3,(H,26,30)
InChIKey CUHXMEGWBXRPBB-UHFFFAOYSA-N
Mol Weight 519.36 g/mol
Molecular Formula C22H17BrF2N4O2S
Exact Mass 518.022366 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 gieoBv0c6l
Name N-(2-bromo-4,6-difluorophenyl)-2-{[4-(2-furylmethyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C22H17BrF2N4O2S/c1-13-4-6-14(7-5-13)21-27-28-22(29(21)11-16-3-2-8-31-16)32-12-19(30)26-20-17(23)9-15(24)10-18(20)25/h2-10H,11-12H2,1H3,(H,26,30)
InChIKey CUHXMEGWBXRPBB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14261
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: D98022; Labnumber: GRES-14504; SBI_ID: SBI-014264
Temperature 305 °C