| SpectraBase Compound ID | K0F1LEYnkmo |
|---|---|
| InChI | InChI=1S/C24H40O3/c1-4-5-6-7-8-9-10-11-12-16-22(25)17-14-13-15-21-18-19-23(26-2)24(20-21)27-3/h18-20H,4-17H2,1-3H3 |
| InChIKey | JKVVNJAGOGVAEI-UHFFFAOYSA-N |
| Mol Weight | 376.6 g/mol |
| Molecular Formula | C24H40O3 |
| Exact Mass | 376.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Xo6eKptPx |
|---|---|
| Name | 1-(3',4'-Dimethoxyphenyl)hexadecan-5-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.297745145 u |
| Formula | C24H40O3 |
| InChI | InChI=1S/C24H40O3/c1-4-5-6-7-8-9-10-11-12-16-22(25)17-14-13-15-21-18-19-23(26-2)24(20-21)27-3/h18-20H,4-17H2,1-3H3 |
| InChIKey | JKVVNJAGOGVAEI-UHFFFAOYSA-N |
| Molecular Weight | 376.581 g/mol |
| SMILES | C=1(C(=CC=C(C1)CCCCC(=O)CCCCCCCCCCC)OC)OC |