SpectraBase Spectrum ID |
K32zazHPMHB |
Name |
Oxalamic acid, N-(4-carbamoylphenyl)-, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.079706870 u |
Formula |
C11H12N2O4 |
InChI |
InChI=1S/C11H12N2O4/c1-2-17-11(16)10(15)13-8-5-3-7(4-6-8)9(12)14/h3-6H,2H2,1H3,(H2,12,14)(H,13,15) |
InChIKey |
PJOLAOATCGOKOZ-UHFFFAOYSA-N |
Molecular Weight |
236.227 g/mol |
SMILES |
C(NC1=CC=C(C=C1)C(N)=O)(=O)C(OCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953612 |