| SpectraBase Spectrum ID |
FFcaDbR2vqq |
| Name |
1H-Indole-3-acetamide, N-(6-acetyl-1,3-benzodioxol-5-yl)-1-methyl-.alpha.-oxo-2-phenyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.137221747 u |
| Formula |
C26H20N2O5 |
| InChI |
InChI=1S/C26H20N2O5/c1-15(29)18-12-21-22(33-14-32-21)13-19(18)27-26(31)25(30)23-17-10-6-7-11-20(17)28(2)24(23)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3,(H,27,31) |
| InChIKey |
NQMUELPIPFTPSG-UHFFFAOYSA-N |
| Molecular Weight |
440.455 g/mol |
| SMILES |
C1=CC=2C(C(C(=O)NC3=C(C=C4C(=C3)OCO4)C(=O)C)=O)=C(N(C2C=C1)C)C=1C=CC=CC1 |
