| SpectraBase Compound ID | 93hqcbbhvs8 |
|---|---|
| InChI | InChI=1S/C18H28O2/c1-4-6-8-10-18(19)17(9-7-5-2)15-11-13-16(20-3)14-12-15/h11-14,17H,4-10H2,1-3H3 |
| InChIKey | MLRSLLSBNHUFSO-UHFFFAOYSA-N |
| Mol Weight | 276.42 g/mol |
| Molecular Formula | C18H28O2 |
| Exact Mass | 276.20893 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 | 54pszvIJN8o |
|---|---|
| Name | 6-Undecanone, 5-(4-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.208930140 u |
| Formula | C18H28O2 |
| InChI | InChI=1S/C18H28O2/c1-4-6-8-10-18(19)17(9-7-5-2)15-11-13-16(20-3)14-12-15/h11-14,17H,4-10H2,1-3H3 |
| InChIKey | MLRSLLSBNHUFSO-UHFFFAOYSA-N |
| Molecular Weight | 276.420 g/mol |
| SMILES | C(C(C=1C=CC(=CC1)OC)CCCC)(=O)CCCCC |