SpectraBase Spectrum ID |
HJ3WWtUKSvZ |
Name |
4'-Nitrosuccinanilic acid |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.058971425 u |
Formula |
C10H10N2O5 |
InChI |
InChI=1S/C10H10N2O5/c13-9(5-6-10(14)15)11-7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,11,13)(H,14,15) |
InChIKey |
TYVJAVSCQNUKPY-UHFFFAOYSA-N |
Molecular Weight |
238.199 g/mol |
SMILES |
N(C1=CC=C(C=C1)N(=O)=O)C(CCC(O)=O)=O |
Spectrum/Structure Validation Score (Raman) |
0.90726 |