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4-(hydroxymethyl)-n-(2-phenylpyrazol-3-…
4-(hydroxymethyl)-n-(2-phenylpyrazol-3-yl)benzenesulfonamide
  • InChIKey: QWBFRRFWEZMWIB-UHFFFAOYSA-N
  • Compound CID: 154699913
  • Molecular Formula: C16H15N3O3S
4-(methylnitrosamino)-4-(3-pyridyl)buta…
4-(methylnitrosamino)-4-(3-pyridyl)butanal (nna)
  • InChIKey: FRJHUNPWTKLYGL-UHFFFAOYSA-N
  • Compound CID: 62228
  • Molecular Formula: C10H13N3O2
4-[2-(methylamino)butyl]benzene-1,2-diol
4-[2-(methylamino)butyl]benzene-1,2-diol
  • InChIKey: VDJBHSSFCFZNAW-UHFFFAOYSA-N
  • Compound CID: 91360001
  • Molecular Formula: C11H17NO2
4-[[4-(dimethylamino) phenyl]-phenylmet…
4-[[4-(dimethylamino) phenyl]-phenylmethyl]-n-methylaniline
  • InChIKey: MCEWFWVFARJELO-UHFFFAOYSA-N
  • Compound CID: 71091427
  • Molecular Formula: C22H24N2
4-[[5-(trifluoromethyl)-2-pyridyl]oxy]p…
4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenol
  • InChIKey: LXXDBPUREVMTMI-UHFFFAOYSA-N
  • Compound CID: 155241
  • Molecular Formula: C12H8F3NO2
4-amino-3,5-dichloro-6-fluoro-2-pyridin…
4-amino-3,5-dichloro-6-fluoro-2-pyridinol
  • InChIKey: JPMASQTVFRLSAV-UHFFFAOYSA-N
  • Compound CID: 175589
  • Molecular Formula: C5H3Cl2FN2O
4-methoxy-6-methyl-1,3,5-triazine-methy…
4-methoxy-6-methyl-1,3,5-triazine-methylamine
  • InChIKey: MNDSUSQBIDHEJU-UHFFFAOYSA-N
  • Compound CID: 160779
  • Molecular Formula: C6H10N4O
5-hydroxy-3p,4p,5p-trimethoxyflavone, 7…
5-hydroxy-3p,4p,5p-trimethoxyflavone, 7-o-glucuronide
  • InChIKey: KEMQFZFXWQLCKM-MJRVOHGCSA-N
  • Compound CID: 154699736
  • Molecular Formula: C24H24O13
5-propyl-1a,7b-dihydrooxireno[2,3-f]qui…
5-propyl-1a,7b-dihydrooxireno[2,3-f]quinoline
  • InChIKey: DZTXKZYGPUGPOX-UHFFFAOYSA-N
  • Compound CID: 154699581
  • Molecular Formula: C12H13NO
5-{[amino(imino)methyl]amino}-2-(benzoy…
5-{[amino(imino)methyl]amino}-2-(benzoylamino)pentanoic acid
  • InChIKey: RSYYQCDERUOEFI-UHFFFAOYSA-N
  • Compound CID: 273355
  • Molecular Formula: C13H18N4O3
6-chloro-5-ethyl-1,3-dihydroindol-2-one
6-chloro-5-ethyl-1,3-dihydroindol-2-one
  • InChIKey: LRZAPTDENMVNNW-UHFFFAOYSA-N
  • Compound CID: 132263367
  • Molecular Formula: C10H10ClNO
6-hydroxy-3-methyl-2-oxo-1,2-dihydroqui…
6-hydroxy-3-methyl-2-oxo-1,2-dihydroquinoline
  • InChIKey: WSWXKTAUERXNAO-UHFFFAOYSA-N
  • Compound CID: 9543197
  • Molecular Formula: C10H9NO2
6-propyl-1a,7b-dihydrooxireno[2,3-h]qui…
6-propyl-1a,7b-dihydrooxireno[2,3-h]quinoline
  • InChIKey: BDFVUGCETZCMBD-UHFFFAOYSA-N
  • Compound CID: 154699503
  • Molecular Formula: C12H13NO
7,8-Dihydroxy-9,10-epoxy-benzo[a]pyrene
7,8-Dihydroxy-9,10-epoxy-benzo[a]pyrene
  • InChIKey: DDBQMRHLXNECKQ-UHFFFAOYSA-N
  • Compound CID: 152023
  • Molecular Formula: C20H10O3
7-ethyl-3-methyl-2-methoxy-2,3-dihydroi…
7-ethyl-3-methyl-2-methoxy-2,3-dihydroindole
  • InChIKey: LNLZPMJJPKIQMN-UHFFFAOYSA-N
  • Compound CID: 49817365
  • Molecular Formula: C12H17NO
[2,5-bis(5-amidino-2-pyridyl)furan]trih…
[2,5-bis(5-amidino-2-pyridyl)furan]trihydrochloride
  • InChIKey: ZWCYKGSVRQXNAR-UHFFFAOYSA-N
  • Compound CID: 118752990
  • Molecular Formula: C16H15ClN6O
[2-chloro-4-(2,4-dichlorophenyl)phenyl]…
[2-chloro-4-(2,4-dichlorophenyl)phenyl] hydrogen sulfate
  • InChIKey: QAPKFUYZESKCHS-UHFFFAOYSA-N
  • Compound CID: 154699891
  • Molecular Formula: C12H7Cl3O4S
beta-1,2,3,4,5,6-hexachlorocyclohexane
beta-1,2,3,4,5,6-hexachlorocyclohexane
  • InChIKey: JLYXXMFPNIAWKQ-UHFFFAOYSA-N
  • Compound CID: 727
  • Molecular Formula: C6H6Cl6
bts 45 186 (2,4,6-trichlorophenol)
bts 45 186 (2,4,6-trichlorophenol)
  • InChIKey: LINPIYWFGCPVIE-UHFFFAOYSA-N
  • Compound CID: 6914
  • Molecular Formula: C6H3Cl3O
c0411; (Acyl-CoA); [M+H]+
c0411; (Acyl-CoA); [M+H]+
  • InChIKey: QRPFCCJPSQOMPY-UHFFFAOYSA-N
  • Compound CID: 5230269
  • Molecular Formula: C31H48N7O18P3S
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Funding support from the European Union’s Horizon 2020 research and innovation program under Grant Agreement No. 101036756 for project “ZeroPM: Zero pollution of persistent, mobile substances”

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