Accession NumberHMDB01485
Common_NameOctane
DescriptionOne of the isomers, 2,2,4-trimethylpentane or isooctane, is of major importance, as it has been selected as the 100 point on the octane rating scale, with n-heptane as the zero point. Octane ratings are ratings used to represent the anti-knock performance of petroleum-based fuels (octane is less likely to prematurely combust under pressure than heptane), given as the percentage of 2,2,4-trimethylpentane in an 2,2,4-trimethylpentane / n-heptane mixture that would have the same performance. It is an important constituent of gasoline. Octane is an alkane with the chemical formula C8H18. It has 18 isomers.
Chemical_IUPAC_Nameoctane
Chemical FormulaC8H18
Sample Concentration1
Mass Value1
Mass Unitmg
ManufacturerQuattro_QQQ
AnalyzerTriple_Quad
DeliveryFlow_Injection
IonizationN/A
Predicted 1H NMR SpectrumDownload
Predicted 1H NMR PeaklistDownload
Predicted 13C NMR SpectrumDownload
Predicted 13C NMR PeaklistDownload
Sample ConcentrationNot Available
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1H NMR SpectrumNot Available
Sample ConcentrationNot Available
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13C NMR SpectrumNot Available
Low Energy Voltage10
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