SynCED ID Name
CAS Number
FormulaStructureSources
CHEM114145{8-Chloro-6-[2-chloro(~2~H_4_)phenyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl}methanol
CASNot Available
C17H8D4Cl2N4O
Avg mass363.230
CHEM103033{5-[2,4-Bis(3-methylmorpholin-4-yl)pyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl}methanol
CAS1009298-09-2
C25H31N5O4
Avg mass465.554
CHEM056068{5-[(Dimethylamino)methyl]furan-2-yl}methanethiol
CAS80646-14-6
C8H13N1O1S1
Avg mass171.260
CHEM044633{5-chloro-2-[(cyclopropylmethyl)amino]phenyl}(phenyl)methanone
CAS2897-00-9
C17H16ClNO
Avg mass285.770
STOFF IDENT Compounds
CHEM121513{4-[5-(4-Fluoro-phenyl)-2-methylsulfanyl-3H-imidazol-4-yl]-pyridin-2-yl}-(1-phenyl-ethyl)-amine
CASNot Available
Not Available
Avg massNot Available
CHEM102094{4-[2-Benzyl-3-methoxy-2-(methoxycarbonyl)-3-oxopropyl]phenyl}sulfamic acid
CASNot Available
C19H21NO7S
Avg massNot Available
CHEM103655{4-[2-Amino-6-(cyclopropylamino)-9h-purin-9-yl]cyclopent-2-en-1-yl}methyl 2-hydroxyacetate
CAS1446418-48-9
C16H20N6O3
Avg mass344.375
CHEM017297{4-[(Ethenyloxy)methyl]cyclohexyl}methanol
CAS114651-37-5
C10H18O2
Avg mass170.252
ToxCast & Tox21 Chemicals
CHEM101864{4-[(6-Chloro-2-methoxy-9,10-dihydroacridin-9-ylidene)amino]pentyl}bis(2-chloroethyl)amine
CASNot Available
C23H28Cl3N3O
Avg mass468.850
CHEM100555{4-[(5-Fluoro-2-hydroxyphenyl)sulfanyl]but-1-en-1-yl}phosphonic acid
CASNot Available
C10H12FO4PS
Avg massNot Available
CHEM102176{4-[(4-Chlorophenyl)methyl]-1-{7h-pyrrolo[2,3-d]pyrimidin-4-yl}piperidin-4-yl}methanamine
CASNot Available
C19H22ClN5
Avg massNot Available
CHEM118843{4-[(4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluorononyl)oxy]phenyl}methanol
CASNot Available
C16H13F13O2
Avg mass484.257
CHEM119522{4-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)oxy]phenyl}methanol
CASNot Available
C18H13F17O2
Avg mass584.273
CHEM102877{4-[(2R)-pyrrolidin-2-ylmethoxy]phenyl}(4-thiophen-3-ylphenyl)methanone
CASNot Available
C22H21NO2S
Avg massNot Available
CHEM077588{4-[(2-Aminoethyl)(carbamoyl)amino]phenyl}(hydroxy)oxoammonium
CASNot Available
C9H13N4O3
Avg massNot Available
CHEM061901{4-[(2,3-Dichlorophenyl)sulfonyl]-1,4-diazepan-1-yl}(2-thienyl)methanone
CASNot Available
C16H16Cl2N2O3S2
Avg massNot Available
CHEM062283{4-[(1,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Heptadecafluoronon-1-en-1-yl)oxy]benzyl}phosphonic acid
CAS63513-12-2
C16H8F17O4P1
Avg massNot Available
CHEM061169{4-Amino-1-[(4-chlorophenyl)methyl]-2-methyl-5-phenyl-1H-pyrrol-3-yl}(phenyl)methanone
CAS1132922-57-6
C25H21Cl1N2O1
Avg mass400.910
CHEM103609{3-[4-(Benzenesulfonyl)thiophene-2-sulfonamido]phenyl}boronic acid
CASNot Available
C16H14BNO6S3
Avg massNot Available
CHEM116742{3-[(E)-2-(1,3-Benzodioxol-5-yl)vinyl]-2-oxiranyl}(1-piperidinyl)methanone
CASNot Available
C17H19NO4
Avg massNot Available
CHEM061826{3-[(4-Benzylpiperazino)methyl]phenyl}(4-hydroxypiperidino)methanone
CASNot Available
C24H31N3O2
Avg massNot Available
CHEM044147{3-[(3,3,4,4,4-pentafluorobutyl)sulfanyl]-2-{[(3,3,4,4,4-pentafluorobutyl)sulfanyl]methyl}-2-[(phosphonooxy)methyl]propoxy}phosphonic acid
CASNot Available
C13H20F10O8P2S2
Avg mass620.350
STOFF IDENT Compounds
CHEM101000{3,8-Dihydroxy-2,6-dioxabicyclo[3.2.1]octan-4-yl}oxidanesulfonic acid
CAS96519-18-5
C6H10O8S
Avg mass242.204
CHEM118077{3,4,5-Tris[1,1,2-trifluoro-2-(heptafluoropropoxy)ethoxy]phenyl}methanol
CASNot Available
C22H8F30O7
Avg mass954.251
CHEM077589{2-[(E)-{1-[(2-chlorophenyl)amino]-1,3-dioxobutan-2-yl}diazenyl]-5-sulfophenyl}(hydroxy)oxoammonium
CASNot Available
C16H14Cl1N4O7S1
Avg massNot Available