| SpectraBase Spectrum ID |
CLs1fpn1Xd1 |
| Name |
Edulimide;N-1-cinnamoyl-N-2-acetyl-N-2-dihydrocinnamoyl-putrescine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.209992767 u |
| Formula |
C24H28N2O3 |
| InChI |
InChI=1S/C24H28N2O3/c1-20(27)26(24(29)17-15-22-12-6-3-7-13-22)19-9-8-18-25-23(28)16-14-21-10-4-2-5-11-21/h2-7,10-14,16H,8-9,15,17-19H2,1H3,(H,25,28)/b16-14+ |
| InChIKey |
JEZVLNLOENILMI-JQIJEIRASA-N |
| Molecular Weight |
392.499 g/mol |
| SMILES |
C(=O)(\C=C\C=1C=CC=CC1)NCCCCN(C(=O)C)C(=O)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900157 |
