SpectraBase Spectrum ID |
KSNN1ki8lxY |
Name |
1,3-Dioxo-N-benzyl-2-indancarboxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
279.089543280 u |
Formula |
C17H13NO3 |
InChI |
InChI=1S/C17H13NO3/c19-15-12-8-4-5-9-13(12)16(20)14(15)17(21)18-10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,18,21) |
InChIKey |
FFLNIHSRNHENAG-UHFFFAOYSA-N |
Molecular Weight |
279.295 g/mol |
SMILES |
C1(C(C(C=2C=CC=CC12)=O)C(=O)NCC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875811 |