C1CC(CC=C1)C=O (cyclohex-3-ene-1-carbaldehyde)
Measured Cetane number: 28.1
Measured using ASTM D6890 IQT. Reference: Dahmen, M. and Marquardt, W., 2015. A novel group contribution method for the prediction of the derived cetane number of oxygenated hydrocarbons. Energy & Fuels, 29(9), pp.5781-5801.
Estimated Cetane number: 25.1
Similar Molecules
SMILES: CC1CCC=CC1
Cetane number (measured): 25.82
SMILES: CC1=CCCCC1
Cetane number (measured): 24.55
SMILES: C1/C=C\CC/C=C\C1
Cetane number (measured): 25.7
SMILES: C1CC=CCCC=C1
Cetane number (measured): 25.7
SMILES: CC1CCC(C(C1)C)C
Cetane number (measured): 24.4
SMILES: CC1CCCC=C1
Cetane number (measured): 24.74
SMILES: CC(CCC=C(C)C)CCO
Cetane number (measured): 25.6
SMILES: C1CC=COC1
Cetane number (measured): 23.9
SMILES: CCCC(C)C(=O)CC
Cetane number (measured): 24.6
SMILES: CC1CCCCC1C
Cetane number (measured): 24.0