| SpectraBase Spectrum ID |
BmdbBogICT4 |
| Name |
5'-Methyl-1'-benzyl-4H-spiro[cyclohexa-2,5-diene-1,3'-indol]-2',4(1'H)-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
315.125928789 u |
| Formula |
C21H17NO2 |
| InChI |
InChI=1S/C21H17NO2/c1-15-7-8-19-18(13-15)21(11-9-17(23)10-12-21)20(24)22(19)14-16-5-3-2-4-6-16/h2-13H,14H2,1H3 |
| InChIKey |
QTBNBWCJKAUJSN-UHFFFAOYSA-N |
| SMILES |
C1(N(C2=C(C11C=CC(C=C1)=O)C=C(C=C2)C)CC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942519 |
![5'-Methyl-1'-benzyl-4H-spiro[cyclohexa-2,5-diene-1,3'-indol]-2',4(1'H)-dione](/api/spectrum/BmdbBogICT4/structure.png?h=300&w=458 "5'-Methyl-1'-benzyl-4H-spiro[cyclohexa-2,5-diene-1,3'-indol]-2',4(1'H)-dione")
