Table 3.

Comparison of maximum mole fractions (GC/MBMS/Model) for some intermediates in the MF/O₂/Ar flame, φ=1.7.

Formula	Species	xmax (GC)	xmax (Model)	xmax (MBMS)
C2H2	Acetylene	2.50E-02	3.14E-02	3.34E-02
C2H6	Ethane	3.16E-03	2.85E-03	2.55E-03
C3H4	Propyne	2.73E-03	0.65E-03	4.76E-03
	Allene	1.07E-03	0.29E-03
C3H6	Propene	1.44E-03	1.44E-03	1.13E-03
C4H4	1-Butene-3-yne	4.20E-03	1.82E-03	2.16E-03
C4H6	1,3-Butadiene	3.36E-03	1.81E-03	2.02E-03
	1,2-Butadiene	2.39E-04	0.81E-04
	2-Butyne	2.43E-04	0.33E-04
C4H8	1-Butene	4.28E-04	3.68E-04	8.62E-04
	2-Butene	1.19E-04	1.56E-04
C5H6	1,3-Cyclop entadiene	2.77E-04	1.17E-05	2.02E-04
	1-Pentene-3-yne	4.29E-05	a
C5H8	1,3-Pentadiene	8.80E-05	2.70E-05	6.88E-05
	Isoprene	8.92E-05	2.75E-05
	2-Pentyne	1.67E-05	1.00E-07
C5H10	2-Pentene	1.69E-04	1.45E-04	1.24E-04
	3-Methyl-1-butene	0.86E-04
	1-Pentene	0.08E-04	1.10E-04
C6H6	Benzene	3.93E-04	0.78E-04	2.75E-04
C7H8	Toluene	6.01E-05	3.71E-05	4.24E-05
C2H4O	Acetaldehyde	8.73E-04	5.00E-04	6.08E-04
	Ethylene oxide	3.81E-06	2.39E-04
C2H6O	Dimethylether	3.79E-05	6.22E-05	2.56E-05
	Ethanol	b	a
C3H6O	Propanal	1.48E-04	6.62E-04	1.75E-04
	Acetone (impurity~7E-04)	1.13E-04	3.74E-06
C4H4O	Furan	c	7.89E-03	3.10E-03
C4H6O	2-Butenone	3.25E-04	a	2.41E-04
	2-Butenal	6.87E-05	a
	Isobutenal	2.09E-05	a
	2,3-Dihydrofuran	3.01E-06	1.17E-04
C4H8O	Isobutanal	1.58E-05	a	4.21E-05
	2-Butanone	5.22E-06	a
C5H8O	3-Penten-2-one	2.07E-05	a	2.41E-04
C6H8O	2-Ethylfuran	2.16E-04	a	2.85E-04
	2,5-DMF	1.37E-05	0.73E-05
	2,4-DMF	1.05E-05	a
C5H4O2	Furfural	2.67E-05	a	6.25E-05

^anot available

^bnot detected

^cidentified, but not quantified