| SpectraBase Compound ID | EXBb937zL45 |
|---|---|
| InChI | InChI=1S/C12H26/c1-6-12(11(4)5)9-7-8-10(2)3/h10-12H,6-9H2,1-5H3 |
| InChIKey | XEMFRSYZKNPRTA-UHFFFAOYSA-N |
| Mol Weight | 170.34 g/mol |
| Molecular Formula | C12H26 |
| Exact Mass | 170.203451 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B2Ii4dlg0oa |
|---|---|
| Name | 3-Ethyl-2,7-dimethyloctane |
| CAS Registry Number | 62183-55-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H26 |
| InChI | InChI=1S/C12H26/c1-6-12(11(4)5)9-7-8-10(2)3/h10-12H,6-9H2,1-5H3 |
| InChIKey | XEMFRSYZKNPRTA-UHFFFAOYSA-N |
| Molecular Weight | 170.340 g/mol |
| SMILES | CC(C(CCCC(C)C)CC)C |
| SPLASH | splash10-052f-9000000000-f61931b08c945901d320 |
| Source of Spectrum | HE-1982-0-0 |
| Synonyms | Octane, 3-ethyl-2,7-dimethyl- |
| Wiley ID | 1167617 |