| SpectraBase Spectrum ID |
LO7KFb34U7P |
| Name |
Piperiline;(2E,4E)-N-[5-(3',4'-methylenedioxy-phenyl)-penta-2,4-dienoyl]-pyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.120843408 u |
| Formula |
C16H17NO3 |
| InChI |
InChI=1S/C16H17NO3/c18-16(17-9-3-4-10-17)6-2-1-5-13-7-8-14-15(11-13)20-12-19-14/h1-2,5-8,11H,3-4,9-10,12H2/b5-1+,6-2+ |
| InChIKey |
GQIJYUMTOUBHSH-IJIVKGSJSA-N |
| SMILES |
C(=O)(\C=C\C=C\C1=CC2=C(C=C1)OCO2)N1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919743 |
![Piperiline;(2E,4E)-N-[5-(3',4'-methylenedioxy-phenyl)-penta-2,4-dienoyl]-pyrrolidine](/api/spectrum/LO7KFb34U7P/structure.png?h=300&w=458 "Piperiline;(2E,4E)-N-[5-(3',4'-methylenedioxy-phenyl)-penta-2,4-dienoyl]-pyrrolidine")
