| SpectraBase Spectrum ID |
BKOUR6MKoxJ |
| Name |
6,7-Dimethoxy-4-methyl-2,3-dihydro-1H-inden-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.094294308 u |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c1-7-6-10(14-2)12(15-3)11-8(7)4-5-9(11)13/h6H,4-5H2,1-3H3 |
| InChIKey |
ATLRPLCSXJDYBA-UHFFFAOYSA-N |
| Molecular Weight |
206.241 g/mol |
| SMILES |
C1(CCC2=C1C(OC)=C(C=C2C)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959931 |
