| SpectraBase Spectrum ID |
j7eni4XTca |
| Name |
(S)-N-(3-Pentynyl)pyrrolidine carboxaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
165.115364106 u |
| Formula |
C10H15NO |
| InChI |
InChI=1S/C10H15NO/c1-2-3-4-7-11-8-5-6-10(11)9-12/h9-10H,4-8H2,1H3/t10-/m0/s1 |
| InChIKey |
CLCFUTWDPOUGDR-JTQLQIEISA-N |
| Molecular Weight |
165.236 g/mol |
| SMILES |
[C@]1(N(CCC1)CCC#CC)(C=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978586 |
