SpectraBase Spectrum ID |
CGdnG7EoCCt |
Name |
Anatabine |
CAS Registry Number |
2743-90-0 |
Classification |
Tobacco alkaloid |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
160.100048394 u |
Formula |
C10H12N2 |
InChI |
InChI=1S/C10H12N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h1-4,6,8,10,12H,5,7H2 |
InChIKey |
SOPPBXUYQGUQHE-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
160.220 g/mol |
Nominal Mass |
160 u |
Quality |
907 |
Retention Index |
1488 |
SMILES |
C1(C=2C=CC=NC2)NCC=CC1 |
SPLASH |
splash10-0a4i-5900000000-c7c7be2cfda31076a5b5 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,2,3,6-Tetrahydro-2,3'-bipyridine |
Technique |
GC/MS |
Wiley ID |
DD2024_027562 |