| SpectraBase Spectrum ID |
69BaijwJXoK |
| Name |
1,2-Dihydro-4-hydroxy-7-nitro-2-oxo-1-phenyl-3-quinolineacetic acid, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.085186173 u |
| Formula |
C18H14N2O6 |
| InChI |
InChI=1S/C18H14N2O6/c1-26-16(21)10-14-17(22)13-8-7-12(20(24)25)9-15(13)19(18(14)23)11-5-3-2-4-6-11/h2-9,22H,10H2,1H3 |
| InChIKey |
USHXSZWCZKXAGS-UHFFFAOYSA-N |
| Molecular Weight |
354.318 g/mol |
| SMILES |
OC1=C(C(N(C=2C=C(C=CC12)N(=O)=O)C=1C=CC=CC1)=O)CC(=O)OC |
| Spectrum/Structure Validation Score (Raman) |
0.741072 |
