| SpectraBase Spectrum ID |
FTK9HBmmHvr |
| Name |
1-Benzyl-2-(2-pyridyl)indole monopicrate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
513.128447965 u |
| Formula |
C26H19N5O7 |
| InChI |
InChI=1S/C20H16N2.C6H3N3O7/c1-2-8-16(9-3-1)15-22-19-12-5-4-10-17(19)14-20(22)18-11-6-7-13-21-18;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-14H,15H2;1-2,10H |
| InChIKey |
TZSHFESZWRMRQO-UHFFFAOYSA-N |
| Molecular Weight |
513.466 g/mol |
| SMILES |
N(=O)(=O)C=1C(=C(C=C(C1)N(=O)=O)N(=O)=O)O.C=12C=CC=CC1N(C(=C2)C=1C=CC=CN1)CC=1C=CC=CC1 |
