| SpectraBase Spectrum ID |
5KbVTn8KrtX |
| Name |
2-Acetylamino-3-amino-1,4-naphthoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.069142187 u |
| Formula |
C12H10N2O3 |
| InChI |
InChI=1S/C12H10N2O3/c1-6(15)14-10-9(13)11(16)7-4-2-3-5-8(7)12(10)17/h2-5H,13H2,1H3,(H,14,15) |
| InChIKey |
IZJNNHJVNPVRHJ-UHFFFAOYSA-N |
| Molecular Weight |
230.223 g/mol |
| SMILES |
C12=C(C(C(=C(C2=O)N)NC(=O)C)=O)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946526 |
