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N-{1-[2-(diethylamino)ethyl]-1H-benzimidazol-2-yl}-3-(1H-1,2,4-triazol-1-yl)-1-adamantanecarboxamide
SpectraBase Compound ID 1fx6W96IJU8
InChI InChI=1S/C26H35N7O/c1-3-31(4-2)9-10-32-22-8-6-5-7-21(22)29-24(32)30-23(34)25-12-19-11-20(13-25)15-26(14-19,16-25)33-18-27-17-28-33/h5-8,17-20H,3-4,9-16H2,1-2H3,(H,29,30,34)
InChIKey PTNYJYGVMSIWRI-UHFFFAOYSA-N
Mol Weight 461.6 g/mol
Molecular Formula C26H35N7O
Exact Mass 461.290309 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Alzq0i3cBFj
Name N-{1-[2-(diethylamino)ethyl]-1H-benzimidazol-2-yl}-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/C26H35N7O/c1-3-31(4-2)9-10-32-22-8-6-5-7-21(22)29-24(32)30-23(34)25-12-19-11-20(13-25)15-26(14-19,16-25)33-18-27-17-28-33/h5-8,17-20H,3-4,9-16H2,1-2H3,(H,29,30,34)
InChIKey PTNYJYGVMSIWRI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19536
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/9144619; UBI_ID: UBI-019540
Temperature 318 °C