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. 2023 Apr 29:1–13. Online ahead of print. doi: 10.1038/s41370-023-00547-9

Table 3.

Most abundant features in each type of samples.

Sample type Compounds DF Peak Area
Soil Caprolactam 90 4.84E + 10
2,2-Methylenebis(4-ethyl-6-tert-butylphenol) 90 3.49E + 09
(9Z)-9-Sulfo-9-octadecenoic acid 100 3E + 09
BOC-GLU-OTBU 100 2.03E + 09
1,7-Hydroxy-3-methylxanthone 90 1.3E + 09
Pentamethylmelamine 90 9.09E + 08
[6]-Gingerol 90 8.68E + 08
N,N’-Diphenylguanidine 60 8.64E + 08
3-O-Butyryl-1,2-O-isopropylidene-alpha-D-glucofuranose 80 7.71E + 08
1-Cyclohexyl-2-azetidinecarboxylic acid 80 6.83E + 08
Dust Dodecyl sulfate 50 3.68E + 10
Myristyl sulfate 70 2.39E + 10
Bis(2-ethylhexyl) phthalate 70 9.83E + 09
Pentadecyl hydrogen sulfate 60 5.36E + 09
Cetyl sulfate 70 4.1E + 09
Linoleic acid 50 2.85E + 09
Haplofungin D 80 2.2E + 09
Tripropyl citrate 90 1.88E + 09
Haplofungin F 80 2.19E + 09
Azelaic acid 40 1.09E + 09
Urine Tetradecanedioic acid 75 5.65E + 10
Hippuric acid 88 3.64E + 10
Piperanine 75 3.49E + 10
S-NONYL-CYSTEINE 63 2.83E + 10
7-Methylguanine 63 2.01E + 10
Cyclo(Ala-Ile) 63 1.86E + 10
N-Phenylacetylglutamine 75 1.23E + 10
Capryloylglycine 75 1.03E + 10
N2,N2-Dimethyl-guanosine 75 1E + 10
Triticonazole 100 2.6E + 09
Food Piperine 60 7.28E + 10
Linoleoyl Ethanolamide 70 3.44E + 09
Choline 90 3.12E + 09
α-Eleostearic acid 50 1.71E + 09
1-(P-TOLYL)-1-CYCLOHEXANECARBONITRILE 50 1.21E + 09
3-hydroxy-N-(1-hydroxy-3-methylpentan-2-yl)-5-oxohexanamide 60 1.1E + 09
UNII:TYL476W27Y 50 7.71E + 08
Makomotine C 50 7.34E + 08
2-(Dipentylamino)-1-(1,2,3,4-tetrahydro-9-phenanthrenyl)ethanol 50 7.24E + 08
4-Indolecarbaldehyde 70 1.56E + 08
Water Jasmone 100 2.63E + 09
6-Phenyl-1-hexanol 80 1.18E + 09
4-Ethoxy ethylbenzoate 100 8.64E + 08
Isophorone 80 8.27E + 08
Valerophenone 80 5.5E + 08
Meleagrin 70 3.76E + 08
Cuminaldehyde 60 1.38E + 08
vanillyl nonanoate 50 9.32E + 08
3721 50 1.5E + 09

DF Detection frequency = # of sample detected the target compounds/# of total samples.