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3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(3-pyridinylmethyl)-1-adamantanecarboxamide
SpectraBase Compound ID HeIz8RR7f7Y
InChI InChI=1S/C19H22N6O3/c26-16(21-10-13-2-1-3-20-9-13)18-5-14-4-15(6-18)8-19(7-14,11-18)24-12-22-17(23-24)25(27)28/h1-3,9,12,14-15H,4-8,10-11H2,(H,21,26)/t14-,15+,18+,19-
InChIKey OHDRYQDFRLRTHY-DJDHSFSDSA-N
Mol Weight 382.42 g/mol
Molecular Formula C19H22N6O3
Exact Mass 382.175339 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1KD5kg0E8If
Name 3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(3-pyridinylmethyl)-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/C19H22N6O3/c26-16(21-10-13-2-1-3-20-9-13)18-5-14-4-15(6-18)8-19(7-14,11-18)24-12-22-17(23-24)25(27)28/h1-3,9,12,14-15H,4-8,10-11H2,(H,21,26)/t14-,15+,18+,19-
InChIKey OHDRYQDFRLRTHY-DJDHSFSDSA-N
NMR Offset 15.3255
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15086
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/6069063; UBI_ID: UBI-015089
Temperature 318 °C