| SpectraBase Spectrum ID |
IoMBJbgcOnb |
| Name |
8-(3-Formylanilino)naphtho-1,2-quinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.073893215 u |
| Formula |
C17H11NO3 |
| InChI |
InChI=1S/C17H11NO3/c19-10-11-3-1-5-13(9-11)18-14-6-2-4-12-7-8-15(20)17(21)16(12)14/h1-10,18H |
| InChIKey |
JZMHZXKAMINUTB-UHFFFAOYSA-N |
| SMILES |
C1=CC=C2C(=C1NC1=CC(=CC=C1)C=O)C(C(=O)C=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888144 |
