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

*Links on SpectraBase are not permalinks.
N-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-1,2,4-triazol-1-yl)-1-adamantanecarboxamide
SpectraBase Compound ID 5UDp1dCjcvL
InChI InChI=1S/C21H20F6N4O/c22-20(23,24)14-2-15(21(25,26)27)4-16(3-14)30-17(32)18-5-12-1-13(6-18)8-19(7-12,9-18)31-11-28-10-29-31/h2-4,10-13H,1,5-9H2,(H,30,32)
InChIKey DJHUAHHAFDPAJE-UHFFFAOYSA-N
Mol Weight 458.41 g/mol
Molecular Formula C21H20F6N4O
Exact Mass 458.15413 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 GarexzlWCEj
Name N-[3,5-bis(trifluoromethyl)phenyl]-3-(1H-1,2,4-triazol-1-yl)-1-adamantanecarboxamide
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/C21H20F6N4O/c22-20(23,24)14-2-15(21(25,26)27)4-16(3-14)30-17(32)18-5-12-1-13(6-18)8-19(7-12,9-18)31-11-28-10-29-31/h2-4,10-13H,1,5-9H2,(H,30,32)
InChIKey DJHUAHHAFDPAJE-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3561
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: UZI/9150219; Labnumber: BAC_UAMK/013496; UZI_ID: UZI-003563
Temperature 308 °C