| SpectraBase Spectrum ID |
J5uGITlaQdP |
| Name |
2,3-bis(3'-Methoxy-2'-nitrophenylimino)-2H-indole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
447.117883281 u |
| Formula |
C22H17N5O6 |
| InChI |
InChI=1S/C22H17N5O6/c1-32-13-7-9-17(19(11-13)26(28)29)23-21-15-5-3-4-6-16(15)24-22(21)25-18-10-8-14(33-2)12-20(18)27(30)31/h3-12H,1-2H3,(H,23,24,25) |
| InChIKey |
XTTNPAMLEZIWHO-UHFFFAOYSA-N |
| Molecular Weight |
447.407 g/mol |
| SMILES |
C=1(\N=C/2\C(NC3=CC=CC=C23)=N\C=2C(N(=O)=O)=CC(=CC2)OC)C(N(=O)=O)=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923995 |
