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3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-dibromophenyl)-1-adamantanecarboxamide

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3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-dibromophenyl)-1-adamantanecarboxamide
SpectraBase Compound ID KzA4hqmPczv
InChI InChI=1S/C19H19Br2ClN4O/c20-13-1-2-15(14(21)4-13)24-16(27)18-5-11-3-12(6-18)8-19(7-11,9-18)26-10-23-17(22)25-26/h1-2,4,10-12H,3,5-9H2,(H,24,27)
InChIKey BJLPGTGSWHQVQA-UHFFFAOYSA-N
Mol Weight 514.65 g/mol
Molecular Formula C19H19Br2ClN4O
Exact Mass 511.961415 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3i2MjcOIa5c
Name 3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-dibromophenyl)-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/C19H19Br2ClN4O/c20-13-1-2-15(14(21)4-13)24-16(27)18-5-11-3-12(6-18)8-19(7-11,9-18)26-10-23-17(22)25-26/h1-2,4,10-12H,3,5-9H2,(H,24,27)
InChIKey BJLPGTGSWHQVQA-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19144
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/9136263; UBI_ID: UBI-019147
Temperature 318 °C