From: Noninvasive detection of lung cancer by analysis of exhaled breath
 | compound name | CAS-number | checked for retention time |
---|---|---|---|
compounds for set A | 2-Butanone | 78-93-3 | 1 |
 | Benzaldehyde | 100-52-7 | 1 |
 | 2,3-Butanedione | 431-03-8 | 0 |
 | 1-Propanol | 71-23-8 | 1 |
add. compounds for set B | 2-Butanone, 3-hydroxy- | 513-86-0 | 1 |
 | 3-Butyn-2-ol | 2028-63-9 | 1 |
 | Butane, 2-methyl- | 78-78-4 | 1 |
 | 2-Butene, 2-methyl- | 513-35-9 | 1 |
 | Acetophenone | 98-86-2 | 1 |
 | 1-Cyclopentene | 142-29-0 | 1 |
 | Methyl propyl sulfide | 3877-15-4 | 1 |
 | Urea, tetramethyl- | 632-22-4 | 1 |
 | n-Pentanal | 110-62-3 | 1 |
 | 1,3-Cyclopentadiene, 1-methyl- | 96-39-9 | 0 |
 | 2-Butanol, 2,3-dimethyl- | 594-60-5 | 1 |
add. compounds for set C | Isoquinoline, 1,2,3,4-tetrahydro- | 91-21-4 | 0 |
 | Undecane, 3,7-dimethyl- | 17301-29-0 | 0 |
 | Benzene, cyclobutyl- | 4392-30-7 | 0 |
 | Butyl acetate | 123-86-4 | 1 |
 | Ethylenimine | 151-56-4 | 0 |
 | n-Undecane | 1120-21-4 | 0 |