| SpectraBase Spectrum ID |
G0gB4fbrUs3 |
| Name |
2-Anilino-3-chloracetylamino-1,4-naphthoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.061469984 u |
| Formula |
C18H13ClN2O3 |
| InChI |
InChI=1S/C18H13ClN2O3/c19-10-14(22)21-16-15(20-11-6-2-1-3-7-11)17(23)12-8-4-5-9-13(12)18(16)24/h1-9,20H,10H2,(H,21,22) |
| InChIKey |
JVPFTZOHSWQMMI-UHFFFAOYSA-N |
| Molecular Weight |
340.766 g/mol |
| SMILES |
C1(C(=C(C(C=2C=CC=CC12)=O)NC(=O)CCl)NC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962646 |
