| SpectraBase Compound ID | KnIOHBiRGU8 |
|---|---|
| InChI | InChI=1S/C22H42O/c1-19-14-12-10-8-6-4-5-7-9-11-13-15-20(2)17-22(23)18-21(3)16-19/h19-21H,4-18H2,1-3H3 |
| InChIKey | MEPYGJWDYAJRKY-UHFFFAOYSA-N |
| Mol Weight | 322.6 g/mol |
| Molecular Formula | C22H42O |
| Exact Mass | 322.323566 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3vASE1qI3Z8 |
|---|---|
| Name | Cyclononadecanone, 3,5,18-trimethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.323565971 u |
| Formula | C22H42O |
| InChI | InChI=1S/C22H42O/c1-19-14-12-10-8-6-4-5-7-9-11-13-15-20(2)17-22(23)18-21(3)16-19/h19-21H,4-18H2,1-3H3 |
| InChIKey | MEPYGJWDYAJRKY-UHFFFAOYSA-N |
| Molecular Weight | 322.577 g/mol |
| SMILES | C1(=O)CC(CC(C)CCCCCCCCCCCCC(C1)C)C |