| SpectraBase Compound ID | EHcfnzhMlg6 |
|---|---|
| InChI | InChI=1S/C14H20O/c1-3-7-12(2)14(15)11-10-13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3 |
| InChIKey | NGPLRUNIUMFFOM-UHFFFAOYSA-N |
| Mol Weight | 204.31 g/mol |
| Molecular Formula | C14H20O |
| Exact Mass | 204.151415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DnnNXaEIehC |
|---|---|
| Name | 4-Methyl-1-phenylheptan-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.151415263 u |
| Formula | C14H20O |
| InChI | InChI=1S/C14H20O/c1-3-7-12(2)14(15)11-10-13-8-5-4-6-9-13/h4-6,8-9,12H,3,7,10-11H2,1-2H3 |
| InChIKey | NGPLRUNIUMFFOM-UHFFFAOYSA-N |
| Molecular Weight | 204.313 g/mol |
| SMILES | C(CC(C(CCC)C)=O)C=1C=CC=CC1 |