From: Blood and breath profiles of volatile organic compounds in patients with end-stage renal disease
VOC | CAS | Rt | Quantifier ion | Blood | Breath/room air | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
LOD | RSD | R2 | Linear range | LOD | RSD | R2 | Linear range | ||||
[min] | [nmol/L] | [%] | Â | [nmol/L] | [ppb] | [%] | [ppb] | ||||
Propane, 2-methyl- | 75-28-5 | 10.86 | 43 | 0.36 | 3.6 | 0.996 | 1.1-16 | 0.3 | 7 | 0.998 | 0.9-30 |
1,3-Butadiene | 106-99-0 | 11.04 | 54 | 0.08 | 5 | 0.997 | 0.25-13 | 0.4 | 1.5 | 0.995 | 1.2-60 |
Acetonitrile | 75-05-8 | 11.32 | 41 | 21 | 14 | 0.998 | 63-11000 | 4 | 8 | 0.999 | 11-150 |
n-Butane | 106-97-8 | 11.78 | 43 | 0.13 | 3.5 | 0.999 | 0.4-16 | 0.2 | 4.5 | 0.988 | 0.6-100 |
2-Propenal | 107-02-8 | 12.80 | 56 | 800 | 9 | 0.965 | 2500-25000 | 0.9 | 7 | 0.997 | 2.7-63 |
Furan | 110-00-9 | 13.32 | 68 | 0.03 | 3 | 0.991 | 0.07-70 | 0.2 | 2 | 0.999 | 0.6-23 |
Propanal | 123-38-6 | 13.42 | 58 | 1.5 | 5 | 0.991 | 4.5-1700 | 0.7 | 3 | 0.997 | 2-150 |
Acetone | 67-64-1 | 13.56 | 58 | - | - | - | - | 0.8 | 3 | 0.999 | 2.4-10000 |
Dimethyl sulfide (DMS) | 75-18-3 | 14.27 | 62 | 0.24 | 1.5 | 0.995 | 0.7-140 | 0.06 | 1.5 | 0.999 | 0.17-60 |
Butane, 2-methyl- | 78-78-4 | 15.90 | 57 | 0.10 | 7 | 0.995 | 0.3-4 | 0.3 | 2 | 0.996 | 0.9-46 |
Isoprene | 78-79-5 | 16.05 | 67 | 0.02 | 3.5 | 0.995 | 0.06-58 | 0.04 | 1.5 | 0.999 | 0.12-500 |
2-Pentene, (Z)- | 627-20-3 | 16.41 | 55 | 0.02 | 6 | 0.989 | 0.06-3.5 | 0.15 | 2.5 | 0.998 | 0.45-20 |
n-Pentane | 109-66-0 | 16.54 | 43 | 0.1 | 2.5 | 0.988 | 0.3-5 | 0.12 | 1.6 | 0.996 | 0.36-60 |
1,3-Pentadiene, (E)- | 2004-70-8 | 16.75 | 67 | 0.02 | 3.4 | 0.999 | 0.06-2 | 0.07 | 1.5 | 0.999 | 0.2-20 |
1,3-Pentadiene, (Z)- | 1574-41-0 | 16.86 | 67 | 0.02 | 4.5 | 0.997 | 0.06-1.5 | 0.07 | 2 | 0.998 | 0.2-13 |
2-Propenal, 2-methyl- | 78-85-3 | 16.92 | 70 | 3 | 9 | 0.993 | 10-250 | 0.1 | 1 | 0.998 | 0.3-50 |
3-Buten-2-one | 78-94-4 | 17.54 | 55 | 40 | 11 | 0.985 | 120-10000 | 0.2 | 7 | 0.998 | 0.6-23 |
Furan, 2-methyl- | 534-22-5 | 18.05 | 82 | 0.02 | 3.5 | 0.993 | 0.06-6.5 | 0.08 | 2 | 0.998 | 0.24-18 |
2,3-Butanedione | 431-03-8 | 18.06 | 86 | 10 | 13 | 0.986 | 30-4000 | 0.4 | 3.3 | 0.994 | 1-200 |
2-Butanone | 78-93-3 | 18.11 | 43 | 0.4 | 6 | 0.999 | 1.3-3000 | 0.13 | 7 | 0.997 | 0.38-250 |
Furan, 3-methyl- | 930-27-8 | 18.21 | 82 | 0.02 | 4 | 0.991 | 0.06-4 | 0.09 | 2 | 0.997 | 0.3-10 |
Ethyl Acetate | 141-78-6 | 18.91 | 43 | 0.3 | 9 | 0.960 | 0.9-400 | 0.13 | 2.5 | 0.996 | 0.39-200 |
Thiophene | 110-02-1 | 19.84 | 84 | 0.04 | 1 | 0.994 | 0.12-6.5 | - | - | - | - |
Pentane, 2-methyl- | 107-83-5 | 19.95 | 43 | 0.3 | 1.5 | 0.993 | 0.9-5 | 0.17 | 1 | 0.999 | 0.53-150 |
1-Pentene, 2-methyl- | 763-29-1 | 19.99 | 56 | 0.07 | 5.5 | 0.997 | 0.2-7 | 0.1 | 3.2 | 0.999 | 0.3-15 |
1-Hexene | 592-41-6 | 20.17 | 56 | 0.03 | 5.5 | 0.997 | 0.09-10 | 0.2 | 1.7 | 0.999 | 0.6-70 |
Pentane, 3-methyl- | 96-14-0 | 20.21 | 57 | 0.12 | 4 | 0.998 | 0.38-5 | 0.08 | 1.5 | 0.999 | 0.24-40 |
Benzene | 71-43-2 | 20.32 | 78 | 0.04 | 3.2 | 0.995 | 0.12-8 | 0.11 | 3.8 | 0.998 | 0.33-36 |
n-Hexane | 110-54-3 | 20.65 | 57 | 0.03 | 2.5 | 0.993 | 0.1-8 | 0.12 | 1.6 | 0.995 | 0.36-110 |
Pyrrole | 109-97-7 | 20.81 | 67 | 0.5 | 14 | 0.982 | 1.5-100 | - | - | - | - |
Cyclohexane | 110-82-7 | 21.33 | 56 | 0.07 | 3 | 0.996 | 0.21-6 | 0.1 | 6 | 0.997 | 0.3-100 |
Pyrimidine | 289-95-2 | 21.64 | 80 | 7 | 12 | 0.990 | 20-950 | - | - | - | - |
2-Pentanone | 107-87-9 | 21.88 | 43 | 1 | 8 | 0.975 | 3-1000 | 0.08 | 2.2 | 0.998 | 0.24-24 |
Furan, 2,5-dimethyl- | 625-86-5 | 22.00 | 96 | 0.08 | 4 | 0.995 | 0.24-5.5 | 0.08 | 1.4 | 0.999 | 0.24-15 |
Sulfide, allyl methyl (AMS) | 10152-76-8 | 22.05 | 88 | 0.1 | 2 | 0.998 | 0.3-15 | 0.14 | 2 | 0.999 | 0.43-15 |
Pyridine | 110-86-1 | 22.05 | 79 | 0.6 | 9 | 0.988 | 2-450 | 0.04 | 9 | 0.975 | 0.12-100 |
Sulfide, methyl propyl (MPS) | 3877-15-4 | 22.67 | 61 | 0.12 | 1.5 | 0.999 | 0.36-50 | 0.04 | 2.1 | 0.996 | 0.12-30 |
Hexane, 2-methyl- | 591-76-4 | 23.60 | 85 | 0.07 | 3 | 0.990 | 0.2-4.5 | 0.09 | 3 | 0.998 | 0.26-11 |
1-Heptene | 592-76-7 | 23.87 | 56 | 0.09 | 5 | 0.998 | 0.27-4.2 | 0.13 | 2 | 0.999 | 0.38-70 |
2-Heptene, (E)- | 592-77-8 | 24.09 | 55 | 0.07 | 6 | 0.996 | 0.21-5.3 | 0.4 | 1.4 | 0.994 | 1.2-13 |
Toluene | 108-88-3 | 24.26 | 91 | 0.02 | 7 | 0.998 | 0.06-15 | 0.05 | 3 | 0.993 | 0.15-30 |
n-Heptane | 142-82-5 | 24.30 | 43 | 0.13 | 2 | 0.997 | 0.4-4 | 0.13 | 1.5 | 0.998 | 0.39-40 |
2-Hexanone | 591-78-6 | 25.49 | 58 | 0.1 | 9 | 0.997 | 0.3-25 | 0.18 | 1 | 0.989 | 0.54-13 |
Heptane, 3-methylene- | 1632-16-2 | 26.91 | 70 | 0.03 | 3 | 0.998 | 0.09-45 | 0.09 | 1 | 0.994 | 0.26-20 |
3-Octene, (E)- | 14919-01-8 | 27.25 | 55 | 0.07 | 4 | 0.991 | 0.2-20 | 0.32 | 2 | 0.991 | 1-13 |
Cyclohexanone | 108-94-1 | 27.41 | 55 | 1.3 | 13 | 0.999 | 4-700 | 0.12 | 8 | 0.956 | 0.34-80 |
p-Xylene | 106-42-3 | 27.68 | 91 | 0.03 | 8 | 0.998 | 0.09-10 | 0.07 | 8 | 0.986 | 0.2-18 |
2-Cyclohexen-1-one | 930-68-7 | 27.89 | 68 | 2 | 12 | 0.998 | 6-460 | 0.1 | 10 | 0.981 | 0.3-15 |
o-Xylene | 95-47-6 | 27.95 | 91 | 0.03 | 7 | 0.998 | 0.09-11 | 0.08 | 9 | 0.991 | 0.24-10 |
4-Heptanone | 123-19-3 | 28.29 | 71 | 0.17 | 9 | 0.997 | 0.5-430 | 0.05 | 6.3 | 0.978 | 0.16-17 |
3-Heptanone | 106-35-4 | 28.51 | 57 | 0.44 | 11 | 0.998 | 1.3-350 | 0.2 | 5 | 0.977 | 0.6-6 |
2-Heptanone | 110-43-0 | 28.68 | 43 | 0.6 | 10 | 0.997 | 1.8-320 | 0.1 | 6.3 | 0.995 | 0.3-9 |
Heptane, 2,4-dimethyl- | 2213-23-2 | 92.01 | 85 | 0.06 | 6 | 0.975 | 0.2-3 | 0.1 | 6 | 0.987 | 0.3-9 |
α-Pinene | 80-56-8 | 30.69 | 93 | 2 | 9 | 0.986 | 6-440 | 0.46 | 8 | 0.985 | 1.4-20 |
Furan, 2-pentyl- | 3777-69-3 | 31.53 | 81 | 3.5 | 13 | 0.989 | 10-350 | - | - | - | - |
3-Carene | 13466-78-9 | 32.09 | 93 | 1.4 | 8 | 0.997 | 4.2-280 | 0.6 | 5.3 | 0.954 | 1.8-12 |
m-Cymene | 535-77-3 | 32.34 | 119 | 0.6 | 9 | 0.992 | 1.8-90 | 0.1 | 5.5 | 0.981 | 0.3-10 |
p-Cymene | 99-87-6 | 32.62 | 119 | 1 | 9.5 | 0.993 | 3-160 | 0.1 | 6 | 0.973 | 0.3-21 |
DL-Limonene | 138-86-3 | 32.84 | 68 | 1 | 9 | 0.983 | 3-1000 | 0.46 | 6 | 0.954 | 1.4-30 |
Eucalyptol | 470-82-6 | 33.40 | 43 | 0.7 | 14 | 0.989 | 2-3 | - | - | - | - |