SpectraBase Spectrum ID |
3CRThIDHQQW |
Name |
1-Ethyl-4-butenyl-quinolizidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
221.214349873 u |
Formula |
C15H27N |
InChI |
InChI=1S/C15H27N/c1-3-5-8-14-11-10-13(4-2)15-9-6-7-12-16(14)15/h5,8,13-15H,3-4,6-7,9-12H2,1-2H3/b8-5+ |
InChIKey |
IZDGBLDKBHHZIC-VMPITWQZSA-N |
Molecular Weight |
221.388 g/mol |
SMILES |
C12N(C(CCC2CC)\C=C\CC)CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860974 |