| SpectraBase Spectrum ID |
6KpFgnSE7VG |
| Name |
1-(p-Methyl-alpha-propylbenzyl)pyrrolidine, hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
253.159727477 u |
| Formula |
C15H24ClN |
| InChI |
InChI=1S/C15H23N.ClH/c1-3-6-15(16-11-4-5-12-16)14-9-7-13(2)8-10-14;/h7-10,15H,3-6,11-12H2,1-2H3;1H |
| InChIKey |
AYJZLDSQPWDSFK-UHFFFAOYSA-N |
| Molecular Weight |
253.817 g/mol |
| SMILES |
Cl.CC1=CC=C(C(CCC)N2CCCC2)C=C1 |
| Spectrum/Structure Validation Score (Raman) |
0.978813 |