For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-[trans-2-(2-Pyridyl)aminocyclooctyl)isoquinoline
SpectraBase Compound ID 59yx1fVvGpo
InChI InChI=1S/C22H25N3/c1-2-4-12-20(25-21-13-7-8-15-23-21)19(11-3-1)22-18-10-6-5-9-17(18)14-16-24-22/h5-10,13-16,19-20H,1-4,11-12H2,(H,23,25)/t19-,20-/m0/s1
InChIKey VZKZREBTFNGOHQ-PMACEKPBSA-N
Mol Weight 331.46 g/mol
Molecular Formula C22H25N3
Exact Mass 331.204848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GzTPbMvTv0D
Name 1-[trans-2-(2-Pyridyl)aminocyclooctyl)isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3
InChI InChI=1S/C22H25N3/c1-2-4-12-20(25-21-13-7-8-15-23-21)19(11-3-1)22-18-10-6-5-9-17(18)14-16-24-22/h5-10,13-16,19-20H,1-4,11-12H2,(H,23,25)/t19-,20-/m0/s1
InChIKey VZKZREBTFNGOHQ-PMACEKPBSA-N
Molecular Weight 331.463 g/mol
SMILES N([C@@]1([C@@](c2c3c(cccc3)ccn2)(CCCCCC1)[H])[H])c1ncccc1
SPLASH splash10-052r-2960000000-26a54d9421d2fc09db41
Source of Spectrum H1-50-362-8
Synonyms N-[(1S,2S)-2-(1-isoquinolinyl)cyclooctyl]-2-pyridinamine N-[(1S,2S)-2-(1-isoquinolinyl)cyclooctyl]-N-(2-pyridinyl)amine
Wiley ID 816764