| SpectraBase Spectrum ID |
LVcHBHoqKri |
| Name |
Trans-2,3,4,4A,5,6,7,¹¹b-octahydro-1H-benzo-[3,4]-cyclohepta-[1,2-B]-pyridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
201.151749616 u |
| Formula |
C14H19N |
| InChI |
InChI=1S/C14H19N/c1-2-7-12-11(5-1)6-3-9-14-13(12)8-4-10-15-14/h1-2,5,7,13-15H,3-4,6,8-10H2/t13-,14-/m0/s1 |
| InChIKey |
OHEKYJQLVQNFGN-KBPBESRZSA-N |
| Molecular Weight |
201.313 g/mol |
| SMILES |
C1N[C@@]2([C@@](CC1)(C1=CC=CC=C1CCC2)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974772 |
![trans-2,3,4,4a,5,6,7,11b-octahydro-1H-benzo[3,4]cyclohepta[1,2-b]pyridine](/api/spectrum/LVcHBHoqKri/structure.png?h=300&w=458 "trans-2,3,4,4a,5,6,7,11b-octahydro-1H-benzo[3,4]cyclohepta[1,2-b]pyridine")
