| SpectraBase Compound ID | 44WP7x3911y |
|---|---|
| InChI | InChI=1S/C16H26O/c1-4-5-6-7-12-16(17-3)13-15-11-9-8-10-14(15)2/h8-11,16H,4-7,12-13H2,1-3H3 |
| InChIKey | QHWBGGJEWYYGJI-UHFFFAOYSA-N |
| Mol Weight | 234.38 g/mol |
| Molecular Formula | C16H26O |
| Exact Mass | 234.198365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6O2q1NeSTUt |
|---|---|
| Name | 1-Methyl-2-(2-methoxyoctyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.198365456 u |
| Formula | C16H26O |
| InChI | InChI=1S/C16H26O/c1-4-5-6-7-12-16(17-3)13-15-11-9-8-10-14(15)2/h8-11,16H,4-7,12-13H2,1-3H3 |
| InChIKey | QHWBGGJEWYYGJI-UHFFFAOYSA-N |
| Molecular Weight | 234.383 g/mol |
| SMILES | C=1(C(=CC=CC1)CC(CCCCCC)OC)C |