SynCED ID Name
CAS Number
FormulaStructureSources
CHEM002207Duloxetine
CAS136434-34-9
C18H19NOS
Avg mass297.415
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002208Chlorpromazine
CAS50-53-3
C17H19ClN2S
Avg mass318.864
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002209Buspirone
CAS36505-84-7
C21H31N5O2
Avg mass385.503
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002210Entacapone
CAS130929-57-6
C14H15N3O5
Avg mass305.286
FooDB ChemicalsSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002211Oxycodone
CAS76-42-6
C18H21NO4
Avg mass315.364
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsT3DB toxins
CHEM002212Cimetidine
CAS51481-61-9
C10H16N6S
Avg mass252.339
FooDB ChemicalsHMDB Contaminants - UrineIARC Carcinogens Group 3STOFF IDENT CompoundsSuspected CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002213Triflupromazine
CAS146-54-3
C18H19F3N2S
Avg mass352.417
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002214Divalproex sodium
CAS76584-70-8
C16H31NaO4
Avg mass310.405
T3DB toxins
CHEM002215Dextromethorphan
CAS125-71-3
C18H25NO
Avg mass271.397
FooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxins
CHEM002216Nortriptyline
CAS72-69-5
C19H21N
Avg mass263.377
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsT3DB toxins
CHEM002217Amoxapine
CAS14028-44-5
C17H16ClN3O
Avg mass313.781
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002218Pyridostigmine
CAS155-97-5
C9H13N2O2
Avg mass181.212
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002219Pentostatin
CAS53910-25-1
C11H16N4O4
Avg mass268.269
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002220Hydroxyzine
CAS68-88-2
C21H27ClN2O2
Avg mass374.904
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002221Benzthiazide
CAS91-33-8
C15H14ClN3O4S3
Avg mass431.937
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002222Carbamazepine
CAS298-46-4
C15H12N2O
Avg mass236.269
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxinsToxCast & Tox21 Chemicals
CHEM002223Clonidine
CAS4205-90-7
C9H9Cl2N3
Avg mass230.094
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002224Mazindol
CAS22232-71-9
C16H13ClN2O
Avg mass284.740
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002225L-Carnitine
CAS541-15-1
C7H15NO3
Avg mass161.199
Cosmetic ChemicalsEAFUS ChemicalsFooDB ChemicalsHMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002226Ethosuximide
CAS77-67-8
C7H11NO2
Avg mass141.168
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002227Thiopental
CAS76-75-5
C11H18N2O2S
Avg mass242.338
HMDB Contaminants - UrineSTOFF IDENT CompoundsSuspected CompoundsSuspected Compounds - Waste WaterSuspected Compounds – Schymanski ProjectT3DB toxins
CHEM002228Cisapride
CAS81098-60-4
C23H29ClFN3O4
Avg mass465.945
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002229Butorphanol
CAS42408-82-2
C21H29NO2
Avg mass327.461
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxins
CHEM002230Rifabutin
CAS72559-06-9
C46H62N4O11
Avg mass847.005
HMDB Contaminants - UrineSTOFF IDENT CompoundsT3DB toxinsToxCast & Tox21 Chemicals
CHEM002231Paramethadione
CAS115-67-3
C7H11NO3
Avg mass157.167
HMDB Contaminants - UrineT3DB toxins