| SpectraBase Compound ID | IjkZAbseKsH |
|---|---|
| InChI | InChI=1S/C13H20/c1-7-13-11(5)9(3)8(2)10(4)12(13)6/h7H2,1-6H3 |
| InChIKey | PIOVGSBSKHQCIJ-UHFFFAOYSA-N |
| Mol Weight | 176.3 g/mol |
| Molecular Formula | C13H20 |
| Exact Mass | 176.156501 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9sYxpjgAETl |
|---|---|
| Name | Benzene, ethylpentamethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.156500644 u |
| Formula | C13H20 |
| InChI | InChI=1S/C13H20/c1-7-13-11(5)9(3)8(2)10(4)12(13)6/h7H2,1-6H3 |
| InChIKey | PIOVGSBSKHQCIJ-UHFFFAOYSA-N |
| Molecular Weight | 176.303 g/mol |
| SMILES | CCC1=C(C)C(C)=C(C(=C1C)C)C |