| SpectraBase Compound ID | HW3H4cRZpjV |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-12(2)7-8-4-5-9(14-3)6-10(8)11(12)13/h4-6H,7H2,1-3H3 |
| InChIKey | NFXFFWSSQPGDOX-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1agsLTXJEeO |
|---|---|
| Name | 6-Methoxy-2,2-dimethyl-1-indanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-12(2)7-8-4-5-9(14-3)6-10(8)11(12)13/h4-6H,7H2,1-3H3 |
| InChIKey | NFXFFWSSQPGDOX-UHFFFAOYSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C1(C2=C(C=CC(=C2)OC)CC1(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977761 |