| SpectraBase Compound ID | GsQjHABzHaB |
|---|---|
| InChI | InChI=1S/C16H18O/c1-3-7-12(2)16(17)15-11-6-9-13-8-4-5-10-14(13)15/h4-6,8-12H,3,7H2,1-2H3 |
| InChIKey | SGQYPNORSXZABK-UHFFFAOYSA-N |
| Mol Weight | 226.32 g/mol |
| Molecular Formula | C16H18O |
| Exact Mass | 226.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EFE3opAgAUe |
|---|---|
| Name | 2-Methyl-1-(1-naphthyl)pentan-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.135765199 u |
| Formula | C16H18O |
| InChI | InChI=1S/C16H18O/c1-3-7-12(2)16(17)15-11-6-9-13-8-4-5-10-14(13)15/h4-6,8-12H,3,7H2,1-2H3 |
| InChIKey | SGQYPNORSXZABK-UHFFFAOYSA-N |
| Molecular Weight | 226.319 g/mol |
| SMILES | C1(=C2C(=CC=C1)C=CC=C2)C(C(CCC)C)=O |