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3-bromo-1-[3-(1-pyrrolidinylcarbonyl)-1-adamantyl]-1H-1,2,4-triazole
SpectraBase Compound ID 778dbun5iSJ
InChI InChI=1S/C17H23BrN4O/c18-15-19-11-22(20-15)17-8-12-5-13(9-17)7-16(6-12,10-17)14(23)21-3-1-2-4-21/h11-13H,1-10H2/t12-,13+,16+,17-
InChIKey OEWZSXFKHBVSOT-GANFFNEQSA-N
Mol Weight 379.3 g/mol
Molecular Formula C17H23BrN4O
Exact Mass 378.105524 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BGIafnQ7SWQ
Name 3-bromo-1-[3-(1-pyrrolidinylcarbonyl)-1-adamantyl]-1H-1,2,4-triazole
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/C17H23BrN4O/c18-15-19-11-22(20-15)17-8-12-5-13(9-17)7-16(6-12,10-17)14(23)21-3-1-2-4-21/h11-13H,1-10H2/t12-,13+,16+,17-
InChIKey OEWZSXFKHBVSOT-GANFFNEQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19685
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/9147860; UBI_ID: UBI-019689
Temperature 308 °C