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

*Links on SpectraBase are not permalinks.

3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-(5-methyl-3-isoxazolyl)-1-adamantanecarboxamide

View entire compound with spectra: 1 NMR

3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-(5-methyl-3-isoxazolyl)-1-adamantanecarboxamide
SpectraBase Compound ID I0ThUowzBqH
InChI InChI=1S/C17H20BrN5O2/c1-10-2-13(22-25-10)20-14(24)16-4-11-3-12(5-16)7-17(6-11,8-16)23-9-19-15(18)21-23/h2,9,11-12H,3-8H2,1H3,(H,20,22,24)/t11-,12+,16+,17-
InChIKey HVYLOUKVUCAUEC-PRRDBKRISA-N
Mol Weight 406.28 g/mol
Molecular Formula C17H20BrN5O2
Exact Mass 405.080038 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 4aitk2CzQd
Name 3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-(5-methyl-3-isoxazolyl)-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/C17H20BrN5O2/c1-10-2-13(22-25-10)20-14(24)16-4-11-3-12(5-16)7-17(6-11,8-16)23-9-19-15(18)21-23/h2,9,11-12H,3-8H2,1H3,(H,20,22,24)/t11-,12+,16+,17-
InChIKey HVYLOUKVUCAUEC-PRRDBKRISA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3826
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/9171471; Labnumber: BAC_UAMK/018938; UZI_ID: UZI-003828
Temperature 308 °C