SpectraBase Spectrum ID |
AIH6ZlNka2Y |
Name |
Dimethyl [[5-(methoxycarbonyl)pentyl]amino]maleate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
287.136887394 u |
Formula |
C13H21NO6 |
InChI |
InChI=1S/C13H21NO6/c1-18-11(15)7-5-4-6-8-14-10(13(17)20-3)9-12(16)19-2/h9,14H,4-8H2,1-3H3/b10-9+ |
InChIKey |
YNTGWECREQJCHK-MDZDMXLPSA-N |
SMILES |
C(OC)(\C=C/(C(OC)=O)NCCCCCC(=O)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803921 |