SpectraBase Spectrum ID |
JSE5z9sbjqT |
Name |
alpha-Pyrrolidinopentiophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.162314299 u |
Formula |
C15H21NO |
InChI |
InChI=1S/C15H21NO/c1-2-8-14(16-11-6-7-12-16)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3 |
InChIKey |
YDIIDRWHPFMLGR-UHFFFAOYSA-N |
Molecular Weight |
231.339 g/mol |
SMILES |
C=1C(=CC=CC1)C(C(CCC)N1CCCC1)=O |
Spectrum/Structure Validation Score (Raman) |
0.958008 |