| SpectraBase Spectrum ID |
1sWchR3QvOl |
| Name |
2,3-di[(2'Hydroxy-5'-methoxy)-phenyl]-trans-1,2,3,4-tetrahydrobenzo[G]quinoxaline-5,10-quinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
458.147786430 u |
| Formula |
C26H22N2O6 |
| InChI |
InChI=1S/C26H22N2O6/c1-33-13-8-10-19(29)18(11-13)22-21(17-9-7-14(34-2)12-20(17)30)27-23-24(28-22)26(32)16-6-4-3-5-15(16)25(23)31/h3-12,21-22,27-30H,1-2H3/t21-,22-/m0/s1 |
| InChIKey |
SEXYUKSIIXWLGB-VXKWHMMOSA-N |
| Molecular Weight |
458.470 g/mol |
| SMILES |
C12=C(N[C@]([C@@](N2)(C=2C(=CC=C(C2)OC)O)[H])(C2=C(C=C(C=C2)OC)O)[H])C(=O)C=2C(C1=O)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957775 |
![2,3-Di[(2'hydroxy-5'-methoxy)-phenyl]-trans-1,2,3,4-tetrahydrobenzo[g]quinoxaline-5,10-quinone](/api/spectrum/1sWchR3QvOl/structure.png?h=300&w=458 "2,3-Di[(2'hydroxy-5'-methoxy)-phenyl]-trans-1,2,3,4-tetrahydrobenzo[g]quinoxaline-5,10-quinone")
