| SpectraBase Compound ID | 7O4Y6Dcoldr |
|---|---|
| InChI | InChI=1S/C16H26/c1-3-4-5-6-7-8-9-13-16-14-11-10-12-15(16)2/h10-12,14H,3-9,13H2,1-2H3 |
| InChIKey | LLJSRZIVUVDGLA-UHFFFAOYSA-N |
| Mol Weight | 218.38 g/mol |
| Molecular Formula | C16H26 |
| Exact Mass | 218.203451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CInz2oxuyjc |
|---|---|
| Name | 1-Methyl-2-nonylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.203450837 u |
| Formula | C16H26 |
| InChI | InChI=1S/C16H26/c1-3-4-5-6-7-8-9-13-16-14-11-10-12-15(16)2/h10-12,14H,3-9,13H2,1-2H3 |
| InChIKey | LLJSRZIVUVDGLA-UHFFFAOYSA-N |
| Molecular Weight | 218.384 g/mol |
| SMILES | C(CCCCCCC)Cc1ccccc1C |