| SpectraBase Spectrum ID |
JbEFEdjYvYt |
| Name |
N-[(-)-jasmonoyl]-(S)-aspartic acid dimethylesther |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
353.183837587 u |
| Formula |
C18H27NO6 |
| InChI |
InChI=1S/C18H27NO6/c1-4-5-6-7-13-12(8-9-15(13)20)10-16(21)19-14(18(23)25-3)11-17(22)24-2/h5-6,12-14H,4,7-11H2,1-3H3,(H,19,21)/b6-5+ |
| InChIKey |
GWLPBQMHLOWLFI-AATRIKPKSA-N |
| Molecular Weight |
353.415 g/mol |
| SMILES |
C(C(NC(CC1C(C(=O)CC1)C\C=C\CC)=O)C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967131 |
![N-[(-)-jasmonoyl]-(S)-aspartic acid dimethylesther](/api/spectrum/JbEFEdjYvYt/structure.png?h=300&w=458 "N-[(-)-jasmonoyl]-(S)-aspartic acid dimethylesther")
