SpectraBase Spectrum ID |
AI0S67J4Ew4 |
Name |
(1rs,2rs,9Asr)-1-benzylamino-2-isopropenylquinolizidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.225248910 u |
Formula |
C19H28N2 |
InChI |
InChI=1S/C19H28N2/c1-15(2)17-11-13-21-12-7-6-10-18(21)19(17)20-14-16-8-4-3-5-9-16/h3-5,8-9,17-20H,1,6-7,10-14H2,2H3 |
InChIKey |
HHBGTEVGXQVBGK-UHFFFAOYSA-N |
SMILES |
C1(C(C(=C)C)CCN2C1CCCC2)NCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966908 |