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4-(1-Adamantylamino)-2,5,6-trichloronicotinonitrile

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(1-Adamantylamino)-2,5,6-trichloronicotinonitrile
SpectraBase Compound ID 3xDqs2bbk4E
InChI InChI=1S/C16H16Cl3N3/c17-12-13(11(7-20)14(18)21-15(12)19)22-16-4-8-1-9(5-16)3-10(2-8)6-16/h8-10H,1-6H2,(H,21,22)/t8-,9+,10-,16-
InChIKey NTZGFGYEJLPQNK-INLNGIGVSA-N
Mol Weight 356.68 g/mol
Molecular Formula C16H16Cl3N3
Exact Mass 355.040981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ds4CilluaHz
Name 3-pyridinecarbonitrile, 2,5,6-trichloro-4-(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)-
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/C16H16Cl3N3/c17-12-13(11(7-20)14(18)21-15(12)19)22-16-4-8-1-9(5-16)3-10(2-8)6-16/h8-10H,1-6H2,(H,21,22)/t8-,9+,10-,16-
InChIKey NTZGFGYEJLPQNK-INLNGIGVSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1185
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: AG-205/6010109; Labnumber: VIK-209; IOH_ID: IOH-008187