Table 2. Best performing VOCs.
VOC | Compound ID | RT | m/z | Average stability score | Identification |
---|---|---|---|---|---|
VOC1 | 2-Pentanone | 5.30598 | 71.04919 | 0.916 | HRAM, Standard |
VOC12 | 1-pentene, 4-methyl, or 1-hexene | 7.62411 | 42.03163 | 0.890 | NIST |
VOC17 | Indole | 17.13762 | 116.90607 | 0.886 | HRAM, Standard |
VOC4 | Dimethyl selenide | 3.30723 | 109.963 | 0.762 | HRAM, Standard |
VOC3 | Limonene | 11.00585 | 91.05427 | 0.734 | HRAM, Standard |
VOC2 | Eucalyptol | 11.34312 | 139.11181 | 0.732 | HRAM, Standard |
VOC29 | Benzene, (1-propylnonyl)- | 20.9004 | 133.19707 | 0.6 | NIST |
HRAM, breath biopsy high resolution accurate mass library; VOC, volatile organic compound; RT, retention time.