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2-amino-4-(4-iodophenyl)-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyridine-3-carbonitrile
SpectraBase Compound ID 6S7mYmgljyY
InChI InChI=1S/C22H26IN3/c23-17-13-11-16(12-14-17)21-18-9-7-5-3-1-2-4-6-8-10-20(18)26-22(25)19(21)15-24/h11-14H,1-10H2,(H2,25,26)
InChIKey KGNMAQPJHDPBND-UHFFFAOYSA-N
Mol Weight 459.38 g/mol
Molecular Formula C22H26IN3
Exact Mass 459.117143 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A1m004K0rWh
Name 2-amino-4-(4-iodophenyl)-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyridine-3-carbonitrile
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/C22H26IN3/c23-17-13-11-16(12-14-17)21-18-9-7-5-3-1-2-4-6-8-10-20(18)26-22(25)19(21)15-24/h11-14H,1-10H2,(H2,25,26)
InChIKey KGNMAQPJHDPBND-UHFFFAOYSA-N
NMR Offset 14.4773
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_16573
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/8141249; UBI_ID: UBI-016576
Temperature 313 °C