SpectraBase Compound ID | GKgOEql8EIr |
---|---|
InChI | InChI=1S/C12H26/c1-5-9-11(7-3)12(8-4)10-6-2/h11-12H,5-10H2,1-4H3 |
InChIKey | XRVCHXCONYJHLU-UHFFFAOYSA-N |
Mol Weight | 170.34 g/mol |
Molecular Formula | C12H26 |
Exact Mass | 170.203451 g/mol |
SpectraBase Spectrum ID | ChcDHciByCH |
---|---|
Name | Octane, 4,5-diethyl- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 170.203450837 u |
Formula | C12H26 |
InChI | InChI=1S/C12H26/c1-5-9-11(7-3)12(8-4)10-6-2/h11-12H,5-10H2,1-4H3 |
InChIKey | XRVCHXCONYJHLU-UHFFFAOYSA-N |
Molecular Weight | 170.340 g/mol |
SMILES | CCC(C(CC)CCC)CCC |