| SpectraBase Compound ID | CKmPY1vkskX |
|---|---|
| InChI | InChI=1S/C21H36O3/c1-16(2)7-10-22-19-13-20(23-11-8-17(3)4)15-21(14-19)24-12-9-18(5)6/h13-18H,7-12H2,1-6H3 |
| InChIKey | WMTAYOAKWZZOFK-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C21H36O3 |
| Exact Mass | 336.266445 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L0Y9Ma4fn62 |
|---|---|
| Name | 1,3,5-Tris(3-methylbutyloxy)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.266445016 u |
| Formula | C21H36O3 |
| InChI | InChI=1S/C21H36O3/c1-16(2)7-10-22-19-13-20(23-11-8-17(3)4)15-21(14-19)24-12-9-18(5)6/h13-18H,7-12H2,1-6H3 |
| InChIKey | WMTAYOAKWZZOFK-UHFFFAOYSA-N |
| Molecular Weight | 336.516 g/mol |
| SMILES | C1(=CC(=CC(=C1)OCCC(C)C)OCCC(C)C)OCCC(C)C |