SpectraBase Spectrum ID |
CXgozIf8rtS |
Name |
4,5-Dihydropiperlonguminine, N-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.167793602 u |
Formula |
C17H23NO3 |
InChI |
InChI=1S/C17H23NO3/c1-13(2)11-18(3)17(19)7-5-4-6-14-8-9-15-16(10-14)21-12-20-15/h5,7-10,13H,4,6,11-12H2,1-3H3/b7-5+ |
InChIKey |
QOCUPCHQSNYBPX-FNORWQNLSA-N |
SMILES |
C12=C(C=CC(=C2)CC\C=C\C(N(CC(C)C)C)=O)OCO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941904 |