| SpectraBase Compound ID | EQk26KDHDgC |
|---|---|
| InChI | InChI=1S/C11H22O2.C11H20O2/c2*1-10(2,3)8(12)7-9(13)11(4,5)6/h8,12H,7H2,1-6H3;7H2,1-6H3 |
| InChIKey | WMNJOSNCYNYRIX-UHFFFAOYSA-N |
| Mol Weight | 370.57 g/mol |
| Molecular Formula | C22H42O4 |
| Exact Mass | 370.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LHdkixG7Y8k |
|---|---|
| Name | 3,5-Heptanedione, 2,2,6,6-tetramethyl-, |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.308309828 u |
| Formula | C22H42O4 |
| InChI | InChI=1S/C11H22O2.C11H20O2/c2*1-10(2,3)8(12)7-9(13)11(4,5)6/h8,12H,7H2,1-6H3;7H2,1-6H3 |
| InChIKey | WMNJOSNCYNYRIX-UHFFFAOYSA-N |
| Molecular Weight | 370.574 g/mol |
| Nominal Mass | 370 u |
| SMILES | CC(C(CC(C(C)(C)C)=O)=O)(C)C.CC(C)(C(CC(C(C)(C)C)O)=O)C |