| SpectraBase Compound ID | Knvg2CEqRa5 |
|---|---|
| InChI | InChI=1S/C18H30/c1-4-7-8-9-12-18-15-16(10-5-2)13-14-17(18)11-6-3/h13-15H,4-12H2,1-3H3 |
| InChIKey | NXEOAJBKXZSMGB-UHFFFAOYSA-N |
| Mol Weight | 246.44 g/mol |
| Molecular Formula | C18H30 |
| Exact Mass | 246.234751 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | kzRB2Xx5By |
|---|---|
| Name | 2,5-di-Propyl-1-cyclohexylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.234750966 u |
| Formula | C18H30 |
| InChI | InChI=1S/C18H30/c1-4-7-8-9-12-18-15-16(10-5-2)13-14-17(18)11-6-3/h13-15H,4-12H2,1-3H3 |
| InChIKey | NXEOAJBKXZSMGB-UHFFFAOYSA-N |
| Molecular Weight | 246.438 g/mol |
| SMILES | C1(=C(C=CC(=C1)CCC)CCC)CCCCCC |