| SpectraBase Compound ID | HmUF4YK5CpL |
|---|---|
| InChI | InChI=1S/C15H18O3/c1-9-5-6-10-8-12(13(16)11(10)7-9)14(17)18-15(2,3)4/h5-7,12H,8H2,1-4H3 |
| InChIKey | KDYBCMALOKSYDS-UHFFFAOYSA-N |
| Mol Weight | 246.31 g/mol |
| Molecular Formula | C15H18O3 |
| Exact Mass | 246.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hbdUrAwQzy |
|---|---|
| Name | Tert-butyl 6-methyl-1-oxo-2,3-dihydro-1H-indene-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.125594437 u |
| Formula | C15H18O3 |
| InChI | InChI=1S/C15H18O3/c1-9-5-6-10-8-12(13(16)11(10)7-9)14(17)18-15(2,3)4/h5-7,12H,8H2,1-4H3 |
| InChIKey | KDYBCMALOKSYDS-UHFFFAOYSA-N |
| Molecular Weight | 246.306 g/mol |
| SMILES | C=1(C=C2C(C(C(OC(C)(C)C)=O)CC2=CC1)=O)C |