| SpectraBase Compound ID | AMXbnNmNgl7 |
|---|---|
| InChI | InChI=1S/C10H10O/c1-7-6-10(11)9-5-3-2-4-8(7)9/h2-5,7H,6H2,1H3 |
| InChIKey | XVTQSYKCADSUHN-UHFFFAOYSA-N |
| Mol Weight | 146.19 g/mol |
| Molecular Formula | C10H10O |
| Exact Mass | 146.073165 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JclIrt7dh83 |
|---|---|
| Name | 3-Methyl-1-indanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.073164941 u |
| Formula | C10H10O |
| InChI | InChI=1S/C10H10O/c1-7-6-10(11)9-5-3-2-4-8(7)9/h2-5,7H,6H2,1H3 |
| InChIKey | XVTQSYKCADSUHN-UHFFFAOYSA-N |
| Molecular Weight | 146.189 g/mol |
| SMILES | C=12C=CC=CC1C(CC2C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.991476 |