| SpectraBase Spectrum ID |
LIgs36qdj1R |
| Name |
1,2,3,4-Tetrahydropyridine-2,6-dicarboxylic acid dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
199.084457899 u |
| Formula |
C9H13NO4 |
| InChI |
InChI=1S/C9H13NO4/c1-13-8(11)6-4-3-5-7(10-6)9(12)14-2/h4,7,10H,3,5H2,1-2H3 |
| InChIKey |
DADOVNQRMHCJOQ-UHFFFAOYSA-N |
| Molecular Weight |
199.206 g/mol |
| SMILES |
C=1(NC(CCC1)C(=O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844504 |
