| SpectraBase Spectrum ID |
9iubstQjvLu |
| Name |
Benzamide, N-(5,8,8A,9,10,10A-hexahydro-4-hydroxy-6,7-dimethyl-9,10-dioxo-1-anthracenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.147058156 u |
| Formula |
C23H21NO4 |
| InChI |
InChI=1S/C23H21NO4/c1-12-10-15-16(11-13(12)2)22(27)20-18(25)9-8-17(19(20)21(15)26)24-23(28)14-6-4-3-5-7-14/h3-9,15-16,25H,10-11H2,1-2H3,(H,24,28) |
| InChIKey |
ALQRXHDUDNTQRF-UHFFFAOYSA-N |
| Molecular Weight |
375.424 g/mol |
| SMILES |
C=12C(C(=O)C3C(C2=O)CC(=C(C)C3)C)=C(O)C=CC1NC(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957541 |
