| SpectraBase Spectrum ID |
GKAqILHsAk3 |
| Name |
Oxalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.120843408 u |
| Formula |
C13H17NO3 |
| InChI |
InChI=1S/C13H17NO3/c1-4-14(12(15)13(16)17-5-2)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3 |
| InChIKey |
NMUPFNWFYVTXRK-UHFFFAOYSA-N |
| Molecular Weight |
235.283 g/mol |
| SMILES |
C(C(=O)N(CC)C=1C=CC=C(C)C1)(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922979 |
