| SpectraBase Spectrum ID |
L7ugazZJLr7 |
| Name |
Succinic acid, 2-(3-nitrophenyl)ethyl propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.121237330 u |
| Formula |
C15H19NO6 |
| InChI |
InChI=1S/C15H19NO6/c1-2-9-21-14(17)6-7-15(18)22-10-8-12-4-3-5-13(11-12)16(19)20/h3-5,11H,2,6-10H2,1H3 |
| InChIKey |
OERSCNCJQXXKSU-UHFFFAOYSA-N |
| Molecular Weight |
309.318 g/mol |
| SMILES |
C(CCC(OCCC1=CC=CC(=C1)N(=O)=O)=O)(OCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89838 |
