| SpectraBase Spectrum ID |
4dmjAWxY5nu |
| Name |
1-Ethyl-3-acetyl-6,7-dimethyl-2-indolinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.125928789 u |
| Formula |
C14H17NO2 |
| InChI |
InChI=1S/C14H17NO2/c1-5-15-13-9(3)8(2)6-7-11(13)12(10(4)16)14(15)17/h6-7,12H,5H2,1-4H3 |
| InChIKey |
SFAAQQFKKRHLSI-UHFFFAOYSA-N |
| Molecular Weight |
231.295 g/mol |
| SMILES |
C1(N(C2=C(C1C(=O)C)C=CC(=C2C)C)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965864 |
