| SpectraBase Compound ID | 36OILToynzv |
|---|---|
| InChI | InChI=1S/C11H10O2/c1-11(2)9(12)7-5-3-4-6-8(7)10(11)13/h3-6H,1-2H3 |
| InChIKey | BNPBWSGZTORGIH-UHFFFAOYSA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C11H10O2 |
| Exact Mass | 174.06808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4EukrDqLzfT |
|---|---|
| Name | 2,2-Dimethyl-1,3-indandione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.068079560 u |
| Formula | C11H10O2 |
| InChI | InChI=1S/C11H10O2/c1-11(2)9(12)7-5-3-4-6-8(7)10(11)13/h3-6H,1-2H3 |
| InChIKey | BNPBWSGZTORGIH-UHFFFAOYSA-N |
| Molecular Weight | 174.199 g/mol |
| SMILES | C=12C=CC=CC1C(C(C2=O)(C)C)=O |