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2-amino-3-(4-chlorophenyl)-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyridine-4-carbonitrile
SpectraBase Compound ID 1qbLeeErMkV
InChI InChI=1S/C22H26ClN3/c23-17-13-11-16(12-14-17)21-19(15-24)18-9-7-5-3-1-2-4-6-8-10-20(18)26-22(21)25/h11-14H,1-10H2,(H2,25,26)
InChIKey XRQNMGNXCSTBAJ-UHFFFAOYSA-N
Mol Weight 367.92 g/mol
Molecular Formula C22H26ClN3
Exact Mass 367.181526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EwX0dnSek2a
Name 2-amino-3-(4-chlorophenyl)-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyridine-4-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/C22H26ClN3/c23-17-13-11-16(12-14-17)21-19(15-24)18-9-7-5-3-1-2-4-6-8-10-20(18)26-22(21)25/h11-14H,1-10H2,(H2,25,26)
InChIKey XRQNMGNXCSTBAJ-UHFFFAOYSA-N
NMR Offset 14.4773
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_16583
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/8143747; UBI_ID: UBI-016586
Temperature 313 °C