Fortified human milk - Organic contaminant
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产品信息
产品说明
LGC Limited is a Licensed Distributor of NIST Standard Reference Materials®, NIST®, STANDARD REFERENCE MATERIAL®, SRM® and depictions or representations thereof, are trademarks and service marks of the National Institute of Standards and Technology of the Department of Commerce. Please register your SRM purchase on the NIST website at www.nist.gov/srm/registration-and-surveys.
分析物数据
分析物名称
浓度
CAS登记号
分子结构
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CAS登记号
备用CAS登记号
无标签CAS登记号
分子式
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分子量
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精确质量测定
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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2,2',4,4',5,5'-Hexabromobiphenyl
精确质量测定
621.5413
SMILES
Brc1cc(Br)c(cc1Br)c2cc(Br)c(Br)cc2Br
InChI
InChI=1S/C12H4Br6/c13-7-3-11(17)9(15)1-5(7)6-2-10(16)12(18)4-8(6)14/h1-4H
IUPAC
1,2,4-tribromo-5-(2,4,5-tribromophenyl)benzene
2,4'-DDD
精确质量测定
317.9537
SMILES
ClC1=CC=C(C=C1)C(C=2C=CC=CC2Cl)C(Cl)Cl
InChI
InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H
IUPAC
1-chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene
2,4'-DDE
精确质量测定
315.938
SMILES
ClC(=C(c1ccc(Cl)cc1)c2ccccc2Cl)Cl
InChI
InChI=1S/C14H8Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8H
IUPAC
1-chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
2,4'-DDT
精确质量测定
351.9147
SMILES
Clc1ccc(cc1)C(c2ccccc2Cl)C(Cl)(Cl)Cl
InChI
InChI=1S/C14H9Cl5/c15-10-7-5-9(6-8-10)13(14(17,18)19)11-3-1-2-4-12(11)16/h1-8,13H
IUPAC
1-chloro-2-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene
4,4'-DDD
精确质量测定
317.9537
SMILES
ClC(Cl)C(c1ccc(Cl)cc1)c2ccc(Cl)cc2
InChI
InChI=1S/C14H10Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13-14H
IUPAC
1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene
4,4'-DDE
精确质量测定
315.938
SMILES
ClC(=C(c1ccc(Cl)cc1)c2ccc(Cl)cc2)Cl
InChI
InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H
IUPAC
1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene
4,4'-DDT
精确质量测定
351.9147
SMILES
Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl
InChI
InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H
IUPAC
1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene
beta-HCH
精确质量测定
287.8601
SMILES
Cl[C@@H]1[C@@H](Cl)[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H]1Cl
InChI
InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3+,4+,5-,6-
IUPAC
1,2,3,4,5,6-hexachlorocyclohexane
Cis-Chlordane (Alpha Isomer)
精确质量测定
405.7978
SMILES
Cl[C@H]1C[C@H]2[C@@H]([C@H]1Cl)[C@@]3(Cl)C(=C(Cl)[C@]2(Cl)C3(Cl)Cl)Cl
InChI
InChI=1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2/t2-,3-,4-,5-,8-,9+/m0/s1
cis-Nonachlor
精确质量测定
439.7588
SMILES
Cl[C@H]1[C@@H](Cl)[C@H]2[C@@H]([C@H]1Cl)[C@]3(Cl)C(=C(Cl)[C@@]2(Cl)C3(Cl)Cl)Cl
InChI
InChI=1S/C10H5Cl9/c11-3-1-2(4(12)5(3)13)9(17)7(15)6(14)8(1,16)10(9,18)19/h1-5H/t1-,2+,3+,4-,5+,8-,9+
gamma-HCH
精确质量测定
287.8601
SMILES
Cl[C@@H]1[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@H]1Cl
InChI
InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5+,6+
IUPAC
1,2,3,4,5,6-hexachlorocyclohexane
Hexachlorobenzene
精确质量测定
281.8131
SMILES
Clc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI
InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9
IUPAC
1,2,3,4,5,6-hexachlorobenzene
Mirex
精确质量测定
539.6262
SMILES
ClC1(Cl)[C@@]2(Cl)[C@]3(Cl)[C@@]4(Cl)C(Cl)(Cl)[C@]5(Cl)[C@@](Cl)([C@@]1(Cl)[C@]35Cl)[C@@]24Cl
InChI
InChI=1S/C10Cl12/c11-1-2(12)7(17)4(14)3(13,5(1,15)9(7,19)20)6(1,16)10(21,22)8(2,4)18/t1-,2-,3-,4-,5-,6+,7+,8-
oxy-Chlordane
精确质量测定
419.777
SMILES
Cl[C@@H]1[C@@H]2[C@H]([C@@H]3O[C@]13Cl)[C@]4(Cl)C(=C(Cl)[C@@]2(Cl)C4(Cl)Cl)Cl
InChI
InChI=1S/C10H4Cl8O/c11-3-1-2(6-9(3,16)19-6)8(15)5(13)4(12)7(1,14)10(8,17)18/h1-3,6H/t1-,2+,3+,6-,7+,8-,9+/m0/s1
PBDE 100 (2,2',4,4',6-Pentabromodiphenyl Ether)
精确质量测定
559.6257
SMILES
Brc1ccc(Oc2c(Br)cc(Br)cc2Br)c(Br)c1
InChI
InChI=1S/C12H5Br5O/c13-6-1-2-11(8(15)3-6)18-12-9(16)4-7(14)5-10(12)17/h1-5H
IUPAC
1,3,5-tribromo-2-(2,4-dibromophenoxy)benzene
PBDE 153 (2,2',4,4',5,5'-Hexabromodiphenyl Ether)
精确质量测定
637.5362
SMILES
Brc1cc(Br)c(Oc2cc(Br)c(Br)cc2Br)cc1Br
InChI
InChI=1S/C12H4Br6O/c13-5-1-9(17)11(3-7(5)15)19-12-4-8(16)6(14)2-10(12)18/h1-4H
IUPAC
1,2,4-tribromo-5-(2,4,5-tribromophenoxy)benzene
PBDE 154 (2,2',4,4',5,6'-Hexabromodiphenyl Ether)
精确质量测定
637.5362
SMILES
Brc1cc(Br)c(Oc2cc(Br)c(Br)cc2Br)c(Br)c1
InChI
InChI=1S/C12H4Br6O/c13-5-1-9(17)12(10(18)2-5)19-11-4-7(15)6(14)3-8(11)16/h1-4H
IUPAC
1,2,4-tribromo-5-(2,4,6-tribromophenoxy)benzene
PBDE 17 (2,2',4-Tribromodiphenyl Ether)
精确质量测定
403.8047
SMILES
Brc1ccc(Oc2ccccc2Br)c(Br)c1
InChI
InChI=1S/C12H7Br3O/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H
IUPAC
2,4-dibromo-1-(2-bromophenoxy)benzene
PBDE 183 (2,2',3,4,4',5',6-Heptabromodiphenyl Ether)
精确质量测定
715.4468
SMILES
Brc1cc(Br)c(Oc2c(Br)cc(Br)c(Br)c2Br)cc1Br
InChI
InChI=1S/C12H3Br7O/c13-4-1-6(15)9(3-5(4)14)20-12-8(17)2-7(16)10(18)11(12)19/h1-3H
IUPAC
1,2,3,5-tetrabromo-4-(2,4,5-tribromophenoxy)benzene
PBDE 209 (2,2',3,3',4,4',5,5',6,6'-Decabromodiphenyl Ether)
精确质量测定
949.1783
SMILES
Brc1c(Br)c(Br)c(Oc2c(Br)c(Br)c(Br)c(Br)c2Br)c(Br)c1Br
InChI
InChI=1S/C12Br10O/c13-1-3(15)7(19)11(8(20)4(1)16)23-12-9(21)5(17)2(14)6(18)10(12)22
IUPAC
1,2,3,4,5-pentabromo-6-(2,3,4,5,6-pentabromophenoxy)benzene
PBDE 28 (2,4,4'-Tribromodiphenyl Ether)
精确质量测定
403.8047
SMILES
Brc1ccc(Oc2ccc(Br)cc2Br)cc1
InChI
InChI=1S/C12H7Br3O/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H
IUPAC
2,4-dibromo-1-(4-bromophenoxy)benzene
PBDE 47 (2,2',4,4'-Tetrabromodiphenyl Ether)
精确质量测定
481.7152
SMILES
Brc1ccc(Oc2ccc(Br)cc2Br)c(Br)c1
InChI
InChI=1S/C12H6Br4O/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6H
IUPAC
2,4-dibromo-1-(2,4-dibromophenoxy)benzene
PBDE 66 (2,3',4,4'-Tetrabromodiphenyl Ether)
精确质量测定
481.7152
SMILES
Brc1ccc(Oc2ccc(Br)c(Br)c2)c(Br)c1
InChI
InChI=1S/C12H6Br4O/c13-7-1-4-12(11(16)5-7)17-8-2-3-9(14)10(15)6-8/h1-6H
IUPAC
1,2-dibromo-4-(2,4-dibromophenoxy)benzene
PBDE 85 (2,2',3,4,4'-Pentabromodiphenyl Ether)
精确质量测定
559.6257
SMILES
Brc1ccc(Oc2ccc(Br)c(Br)c2Br)c(Br)c1
InChI
InChI=1S/C12H5Br5O/c13-6-1-3-9(8(15)5-6)18-10-4-2-7(14)11(16)12(10)17/h1-5H
IUPAC
1,2,3-tribromo-4-(2,4-dibromophenoxy)benzene
PBDE 99 (2,2',4,4',5-Pentabromodiphenyl Ether)
精确质量测定
559.6257
SMILES
Brc1ccc(Oc2cc(Br)c(Br)cc2Br)c(Br)c1
InChI
InChI=1S/C12H5Br5O/c13-6-1-2-11(9(16)3-6)18-12-5-8(15)7(14)4-10(12)17/h1-5H
IUPAC
1,2,4-tribromo-5-(2,4-dibromophenoxy)benzene
PCB 199
精确质量测定
425.7665
SMILES
Clc1cc(c(Cl)c(Cl)c1Cl)c2c(Cl)c(Cl)cc(Cl)c2Cl
InChI
InChI=1S/C12H2Cl8/c13-4-1-3(8(16)12(20)11(4)19)7-9(17)5(14)2-6(15)10(7)18/h1-2H
IUPAC
1,2,3,4-tetrachloro-5-(2,3,5,6-tetrachlorophenyl)benzene
PCB 99 (2,2',4,4',5-Pentachlorobiphenyl)
精确质量测定
323.8834
SMILES
Clc1ccc(c(Cl)c1)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H5Cl5/c13-6-1-2-7(9(14)3-6)8-4-11(16)12(17)5-10(8)15/h1-5H
IUPAC
1,2,4-trichloro-5-(2,4-dichlorophenyl)benzene
PCB No. 101
精确质量测定
323.8834
SMILES
Clc1ccc(Cl)c(c1)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H5Cl5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H
IUPAC
1,2,4-trichloro-5-(2,5-dichlorophenyl)benzene
PCB No. 105
精确质量测定
323.8834
SMILES
Clc1ccc(cc1Cl)c2ccc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H5Cl5/c13-8-3-1-6(5-10(8)15)7-2-4-9(14)12(17)11(7)16/h1-5H
IUPAC
1,2,3-trichloro-4-(3,4-dichlorophenyl)benzene
PCB No. 110
精确质量测定
323.8834
SMILES
Clc1ccc(cc1Cl)c2c(Cl)ccc(Cl)c2Cl
InChI
InChI=1S/C12H5Cl5/c13-7-2-1-6(5-10(7)16)11-8(14)3-4-9(15)12(11)17/h1-5H
IUPAC
1,2,4-trichloro-3-(3,4-dichlorophenyl)benzene
PCB No. 118
精确质量测定
323.8834
SMILES
Clc1ccc(cc1Cl)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H5Cl5/c13-8-2-1-6(3-10(8)15)7-4-11(16)12(17)5-9(7)14/h1-5H
IUPAC
1,2,4-trichloro-5-(3,4-dichlorophenyl)benzene
PCB No. 128
精确质量测定
357.8444
SMILES
Clc1ccc(c(Cl)c1Cl)c2ccc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-7-3-1-5(9(15)11(7)17)6-2-4-8(14)12(18)10(6)16/h1-4H
IUPAC
1,2,3-trichloro-4-(2,3,4-trichlorophenyl)benzene
PCB No. 138
精确质量测定
357.8444
SMILES
Clc1cc(Cl)c(cc1Cl)c2ccc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-7-2-1-5(11(17)12(7)18)6-3-9(15)10(16)4-8(6)14/h1-4H
IUPAC
1,2,3-trichloro-4-(2,4,5-trichlorophenyl)benzene
PCB No. 146
精确质量测定
357.8444
SMILES
Clc1cc(Cl)c(Cl)c(c1)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H4Cl6/c13-5-1-7(12(18)11(17)2-5)6-3-9(15)10(16)4-8(6)14/h1-4H
IUPAC
1,2,4-trichloro-5-(2,3,5-trichlorophenyl)benzene
PCB No. 149
精确质量测定
357.8444
SMILES
Clc1cc(Cl)c(cc1Cl)c2c(Cl)ccc(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-6-1-2-7(14)12(18)11(6)5-3-9(16)10(17)4-8(5)15/h1-4H
IUPAC
1,2,4-trichloro-3-(2,4,5-trichlorophenyl)benzene
PCB No. 151
精确质量测定
357.8444
SMILES
Clc1ccc(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-5-1-2-7(14)6(3-5)10-11(17)8(15)4-9(16)12(10)18/h1-4H
IUPAC
1,2,4,5-tetrachloro-3-(2,5-dichlorophenyl)benzene
PCB No. 153
精确质量测定
357.8444
SMILES
Clc1cc(Cl)c(cc1Cl)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H4Cl6/c13-7-3-11(17)9(15)1-5(7)6-2-10(16)12(18)4-8(6)14/h1-4H
IUPAC
1,2,4-trichloro-5-(2,4,5-trichlorophenyl)benzene
PCB No. 156
精确质量测定
357.8444
SMILES
Clc1ccc(cc1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-7-2-1-5(3-8(7)14)6-4-9(15)11(17)12(18)10(6)16/h1-4H
IUPAC
1,2,3,4-tetrachloro-5-(3,4-dichlorophenyl)benzene
PCB No. 157
精确质量测定
357.8444
SMILES
Clc1ccc(c(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2
InChI
InChI=1S/C12H4Cl6/c13-7-2-1-6(10(16)12(7)18)5-3-8(14)11(17)9(15)4-5/h1-4H
IUPAC
1,2,3-trichloro-4-(3,4,5-trichlorophenyl)benzene
PCB No. 158
精确质量测定
357.8444
SMILES
Clc1ccc(cc1Cl)c2c(Cl)cc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H4Cl6/c13-6-2-1-5(3-7(6)14)10-8(15)4-9(16)11(17)12(10)18/h1-4H
IUPAC
1,2,3,5-tetrachloro-4-(3,4-dichlorophenyl)benzene
PCB No. 167
精确质量测定
357.8444
SMILES
Clc1cc(Cl)c(cc1Cl)c2cc(Cl)c(Cl)c(Cl)c2
InChI
InChI=1S/C12H4Cl6/c13-7-4-9(15)8(14)3-6(7)5-1-10(16)12(18)11(17)2-5/h1-4H
IUPAC
1,2,3-trichloro-5-(2,4,5-trichlorophenyl)benzene
PCB No. 170
精确质量测定
391.8054
SMILES
Clc1ccc(c(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-6-2-1-4(8(15)10(6)17)5-3-7(14)11(18)12(19)9(5)16/h1-3H
IUPAC
1,2,3,4-tetrachloro-5-(2,3,4-trichlorophenyl)benzene
PCB No. 172
精确质量测定
391.8054
SMILES
Clc1cc(Cl)c(Cl)c(c1)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-4-1-5(9(16)7(14)2-4)6-3-8(15)11(18)12(19)10(6)17/h1-3H
IUPAC
1,2,3,4-tetrachloro-5-(2,3,5-trichlorophenyl)benzene
PCB No. 177
精确质量测定
391.805
SMILES
Clc1ccc(c(Cl)c1Cl)c2c(Cl)c(Cl)cc(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-5-2-1-4(9(16)12(5)19)8-10(17)6(14)3-7(15)11(8)18/h1-3H
IUPAC
1,2,4,5-tetrachloro-3-(2,3,4-trichlorophenyl)benzene
PCB No. 178
精确质量测定
391.8054
SMILES
Clc1cc(Cl)c(Cl)c(c1)c2c(Cl)c(Cl)cc(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-4-1-5(10(17)6(14)2-4)9-11(18)7(15)3-8(16)12(9)19/h1-3H
IUPAC
1,2,4,5-tetrachloro-3-(2,3,5-trichlorophenyl)benzene
PCB No. 18
精确质量测定
255.9613
SMILES
Clc1ccc(Cl)c(c1)c2ccccc2Cl
InChI
InChI=1S/C12H7Cl3/c13-8-5-6-12(15)10(7-8)9-3-1-2-4-11(9)14/h1-7H
IUPAC
1,4-dichloro-2-(2-chlorophenyl)benzene
PCB No. 180
精确质量测定
391.8054
SMILES
Clc1cc(Cl)c(cc1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-6-3-8(15)7(14)1-4(6)5-2-9(16)11(18)12(19)10(5)17/h1-3H
IUPAC
1,2,3,4-tetrachloro-5-(2,4,5-trichlorophenyl)benzene
PCB No. 183
精确质量测定
391.8054
SMILES
Clc1cc(Cl)c(cc1Cl)c2c(Cl)cc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-5-2-7(15)6(14)1-4(5)10-8(16)3-9(17)11(18)12(10)19/h1-3H
IUPAC
1,2,3,5-tetrachloro-4-(2,4,5-trichlorophenyl)benzene
PCB No. 187
精确质量测定
391.8054
SMILES
Clc1cc(Cl)c(cc1Cl)c2c(Cl)c(Cl)cc(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-5-2-7(15)6(14)1-4(5)10-11(18)8(16)3-9(17)12(10)19/h1-3H
IUPAC
1,2,4,5-tetrachloro-3-(2,4,5-trichlorophenyl)benzene
PCB No. 189
精确质量测定
391.8054
SMILES
Clc1cc(cc(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H3Cl7/c13-6-1-4(2-7(14)10(6)17)5-3-8(15)11(18)12(19)9(5)16/h1-3H
IUPAC
1,2,3,4-tetrachloro-5-(3,4,5-trichlorophenyl)benzene
PCB No. 194
精确质量测定
425.7665
SMILES
Clc1cc(c(Cl)c(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H2Cl8/c13-5-1-3(7(15)11(19)9(5)17)4-2-6(14)10(18)12(20)8(4)16/h1-2H
IUPAC
1,2,3,4-tetrachloro-5-(2,3,4,5-tetrachlorophenyl)benzene
PCB No. 195
精确质量测定
425.7665
SMILES
Clc1ccc(c(Cl)c1Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H2Cl8/c13-4-2-1-3(6(14)7(4)15)5-8(16)10(18)12(20)11(19)9(5)17/h1-2H
IUPAC
1,2,3,4,5-pentachloro-6-(2,3,4-trichlorophenyl)benzene
PCB No. 196
精确质量测定
425.7665
SMILES
Clc1cc(Cl)c(c(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H2Cl8/c13-4-2-6(15)9(17)11(19)7(4)3-1-5(14)10(18)12(20)8(3)16/h1-2H
IUPAC
1,2,3,4-tetrachloro-5-(2,3,4,6-tetrachlorophenyl)benzene
PCB No. 206
精确质量测定
459.7275
SMILES
Clc1cc(c(Cl)c(Cl)c1Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12HCl9/c13-3-1-2(5(14)9(18)6(3)15)4-7(16)10(19)12(21)11(20)8(4)17/h1H
IUPAC
1,2,3,4,5-pentachloro-6-(2,3,4,5-tetrachlorophenyl)benzene
PCB No. 209
精确质量测定
493.6885
SMILES
Clc1c(Cl)c(Cl)c(c(Cl)c1Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12Cl10/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16
IUPAC
1,2,3,4,5-pentachloro-6-(2,3,4,5,6-pentachlorophenyl)benzene
PCB No. 28
精确质量测定
255.9613
SMILES
Clc1ccc(cc1)c2ccc(Cl)cc2Cl
InChI
InChI=1S/C12H7Cl3/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7H
IUPAC
2,4-dichloro-1-(4-chlorophenyl)benzene
PCB No. 44
精确质量测定
289.9224
SMILES
Clc1ccc(Cl)c(c1)c2cccc(Cl)c2Cl
InChI
InChI=1S/C12H6Cl4/c13-7-4-5-10(14)9(6-7)8-2-1-3-11(15)12(8)16/h1-6H
IUPAC
1,2-dichloro-3-(2,5-dichlorophenyl)benzene
PCB No. 49
精确质量测定
289.9224
SMILES
Clc1ccc(c(Cl)c1)c2cc(Cl)ccc2Cl
InChI
InChI=1S/C12H6Cl4/c13-7-2-4-11(15)10(5-7)9-3-1-8(14)6-12(9)16/h1-6H
IUPAC
1,4-dichloro-2-(2,4-dichlorophenyl)benzene
PCB No. 52
精确质量测定
289.9224
SMILES
Clc1ccc(Cl)c(c1)c2cc(Cl)ccc2Cl
InChI
InChI=1S/C12H6Cl4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H
IUPAC
1,4-dichloro-2-(2,5-dichlorophenyl)benzene
PCB No. 66
精确质量测定
289.9224
SMILES
Clc1ccc(c(Cl)c1)c2ccc(Cl)c(Cl)c2
InChI
InChI=1S/C12H6Cl4/c13-8-2-3-9(11(15)6-8)7-1-4-10(14)12(16)5-7/h1-6H
IUPAC
1,2-dichloro-4-(2,4-dichlorophenyl)benzene
PCB No. 74
精确质量测定
289.9224
SMILES
Clc1ccc(cc1)c2cc(Cl)c(Cl)cc2Cl
InChI
InChI=1S/C12H6Cl4/c13-8-3-1-7(2-4-8)9-5-11(15)12(16)6-10(9)14/h1-6H
IUPAC
1,2,4-trichloro-5-(4-chlorophenyl)benzene
PCB No. 87
精确质量测定
323.8834
SMILES
Clc1ccc(Cl)c(c1)c2ccc(Cl)c(Cl)c2Cl
InChI
InChI=1S/C12H5Cl5/c13-6-1-3-9(14)8(5-6)7-2-4-10(15)12(17)11(7)16/h1-5H
IUPAC
1,2,3-trichloro-4-(2,5-dichlorophenyl)benzene
Trans-Chlordane (Gamma Isomer)
精确质量测定
405.7978
SMILES
Cl[C@@H]1C[C@H]2[C@@H]([C@H]1Cl)[C@@]3(Cl)C(=C(Cl)[C@]2(Cl)C3(Cl)Cl)Cl
InChI
InChI=1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2/t2-,3+,4-,5-,8-,9+/m0/s1
trans-Nonachlor
精确质量测定
439.7588
SMILES
Cl[C@@H]1[C@@H](Cl)[C@H]2[C@@H]([C@H]1Cl)[C@]3(Cl)C(=C(Cl)[C@@]2(Cl)C3(Cl)Cl)Cl
InChI
InChI=1S/C10H5Cl9/c11-3-1-2(4(12)5(3)13)9(17)7(15)6(14)8(1,16)10(9,18)19/h1-5H/t1-,2+,3+,4-,5-,8-,9+
产品数据
存储温度
-20°C
运输温度
Room Temperature
原产国
UNITED STATES
关税代码
38220000
产品形式
Matrix Material
基质
Human milk