| SpectraBase Spectrum ID |
IWg2ZuU5LBb |
| Name |
1H-Indene-6-carboxaldehyde, 3,7-dimethyl-5-(1-methylethyl)-1-oxo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.115029753 u |
| Formula |
C15H16O2 |
| InChI |
InChI=1S/C15H16O2/c1-8(2)11-6-12-9(3)5-14(17)15(12)10(4)13(11)7-16/h5-8H,1-4H3 |
| InChIKey |
JMBXORIGOBWDJL-UHFFFAOYSA-N |
| Molecular Weight |
228.291 g/mol |
| SMILES |
C12=C(C(=O)C=C2C)C(C)=C(C(=C1)C(C)C)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932989 |
