SynCED ID Name
CAS Number
FormulaStructureSources
CHEM002332Rifampin
CAS13292-46-1
C43H58N4O12
Avg mass822.953
HMDB Contaminants - UrineIARC Carcinogens Group 3STOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002333Ibuprofen
CAS15687-27-1
C13H18O2
Avg mass206.281
FooDB ChemicalsHMDB Contaminants - UrineHPV EPA ChemicalsSTOFF IDENT CompoundsSuspected CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxinsToxCast & Tox21 Chemicals
CHEM002334Melatonin
CAS73-31-4
C13H16N2O2
Avg mass232.278
FooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002335Clonazepam
CAS1622-61-3
C15H10ClN3O3
Avg mass315.711
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002336Dihydrotachysterol
CAS67-96-9
C28H46O
Avg mass398.664
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002337Perhexiline
CAS6621-47-2
C19H35N
Avg mass277.488
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002338Diphenhydramine
CAS58-73-1
C17H21NO
Avg mass255.355
FooDB ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002339Vigabatrin
CAS60643-86-9
C6H11NO2
Avg mass129.157
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002340Diphenoxylate
CAS915-30-0
C30H32N2O2
Avg mass452.587
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002341Pilocarpine
CAS54-71-7
C11H16N2O2
Avg mass208.257
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002342Benzocaine
CAS94-09-7
C9H11NO2
Avg mass165.189
Cosmetic ChemicalsFooDB ChemicalsHPV EPA ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002343Dimethyl sulfoxide
CAS67-68-5
C2H6OS
Avg mass78.133
EAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - FecesHPV EPA ChemicalsOECD HPV ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002344Flucytosine
CAS2022-85-7
C4H4FN3O
Avg mass129.093
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002345Pimozide
CAS2062-78-4
C28H29F2N3O
Avg mass461.546
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002346Sertraline
CAS79617-96-2
C17H17Cl2N
Avg mass306.230
FooDB ChemicalsSTOFF IDENT CompoundsSuspected CompoundsT3DB toxins
CHEM002347Sibutramine
CAS106650-56-0
C17H26ClN
Avg mass279.848
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002348Methyprylon
CAS125-64-4
C10H17NO2
Avg mass183.248
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002349Miconazole
CAS22916-47-8
C18H14Cl4N2O
Avg mass416.129
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002350Chlorpheniramine
CAS132-22-9
C16H19ClN2
Avg mass274.788
FooDB ChemicalsT3DB toxins
CHEM002351Phenacemide
CAS63-98-9
C9H10N2O2
Avg mass178.188
FooDB ChemicalsHMDB Contaminants - UrineT3DB toxinsToxCast & Tox21 Chemicals
CHEM002352Ambenonium
CAS7648-98-8
C28H42Cl2N4O2
Avg mass537.565
HMDB Contaminants - UrineT3DB toxins
CHEM002353Econazole
CAS27220-47-9
C18H15Cl3N2O
Avg mass381.684
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002354Doxepin
CAS1668-19-5
C19H21NO
Avg mass279.383
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsT3DB toxins
CHEM002355Nefazodone
CAS83366-66-9
C25H32ClN5O2
Avg mass470.007
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002356Desipramine
CAS50-47-5
C18H22N2
Avg mass266.381
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins