Supporting Information Waste water treatment plants as sources of polyfluorinated compounds, polybrominated diphenyl ethers and musk fragrances to ambient air



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Chemicals


Table S3: Solvents, native and mass-labelled analytical standards and gases used in this study.

Substance

Acronym

Purity

Supplier

2-Perfluorohexyl-(13C2)-ethanol

13C 6:2 FTOH

> 98

Wellington, Guelph, Canada

2-Perfluorooctyl-(13C2)-ethanol

13C 8:2 FTOH

> 98

Wellington, Guelph, Canada

2-Perfluorodecyl-(13C2)-ethanol

13C 10:2 FTOH

> 98

Wellington, Guelph, Canada

methyl-D3-perfluorooctane sulfonamide

MeFOSA D3

> 98

Wellington, Guelph, Canada

ethyl-D5-perfluorooctane sulfonamide

EtFOSA D5

> 98

Wellington, Guelph, Canada

methyl-D7-perfluorooctane sulfonamido ethanol

MeFOSE D7

> 98

Wellington, Guelph, Canada

ethyl-D9-perfluorooctane sulfonamidoethanol

MeFOSE D9

> 98

Wellington, Guelph, Canada

perfluoro-(13C4)-butanoic acid

13C PFBA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-hexanoic acid

13C PFHxA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-octanoic acid

13C PFOA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-nonanoic acid

13C PFNA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-decanoic acid

13C PFDA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-undecanoic acid

13C PFUnDA

>98

Wellington, Guelph, Canada

perfluoro-(13C4)-dodecanoic acid

13C PFDoA

>98

Wellington, Guelph, Canada

sodium perfluoro-(18O2)-hexane sulfonate

18O2-PFHxS

>99

Wellington, Guelph, Canada

sodium perfluoro-(13C4)-octane sulfonate

13C-PFOS

>98

Wellington, Guelph, Canada

sodium perfluoro-(13C4)-octane sulfinate

13C-PFOSi

~90

Wellington, Guelph, Canada

hexachlorobenzene 13C6

13C HCB

97

Dr. Ehrenstorfer, Augsburg, Germany

1,3,5-trichlorobenzene D3

TCB D3

98

Aldrich, Munich, Germany

perfluorooctane sulfonamido-D5-acetic acid

EtFOSAA D5

>98

Wellington, Guelph, Canada

perfluorobutyl ethanol

4:2 FTOH

97

Aldrich, Munich, Germany

perfluorohexyl ethanol

6:2 FTOH

97

Lancaster Synthesis, Frankfurt, Germany

perfluorooctyl ethanol

8:2 FTOH

97

Lancaster Synthesis, Frankfurt, Germany

perfluorodecyl ethanol

10:2 FTOH

97

Lancaster Synthesis, Frankfurt, Germany

perfluorododecyl ethanol

12:2 FTOH

-

Donated by Lancaster University, UK

perfluorohexyl ethylacylate

6:2 FTA

97

Aldrich, Munich, Germany

perfluorooctyl ethylacylate

8:2 FTA

97

Fluorochem, Old Glossop, UK

perfluorodecyl ethylacylate

10:2 FTA

97

Fluorochem, Old Glossop, UK

n-methyl perfluorobutane sulfonamide

MeFBSA

-

donated by 3M, Germany

n-methyl perfluorooctane sulfonamide

MeFOSA

-

donated by 3M, Germany

n-ethyl perfluorooctane sulfonamide

EtFOSA

95

ABCR, Karlsruhe, Germany

perfluorooctane sulfonamide

PFOSA

-

donated by 3M, USA

dimethylperfluoroocatane sulfonamide

Me2FOSA

98

Wellington, Guelph, Canada

n-methyl perfluorobutane sulfonamido ethanol

MeFBSE

-

donated by 3M, USA

n-methyl perfluorooctane sulfonamido ethanol

MeFOSE

-

donated by 3M, USA

n-ethyl perfluorooctane sulfonamido ethanol

EtFOSE

-

donated by Toronto University, Canada

Perfluorobutanoic acid

PFBA

99

ABCR, Karlsruhe, Germany

perfluoropentanoic acid

PFPA

98

Alfa Aesar, Karlsruhe, Germany

Perfluorohexanoic acid

PFHxA

98

ABCR, Karlsruhe, Germany

perfluoroheptanoic acid

PFHpA

98

Lancaster, Frankfurt, Germany


Table S2 cont.

Substance

Acronym

Purity

Supplier

perfluorooctanoic acid

PFOA

95

Lancaster, Frankfurt, Germany

perfluorooctanoic acid

PFOA

95

Lancaster, Frankfurt, Germany

Perfluorononanoic acid

PFNA

98

Alfa Aesar, Karlsruhe, Germany

Perfluorodecanoic acid

PFDA

98

ABCR, Karlsruhe, Germany

perfluoroundecanoic acid

PFUnDA

96

ABCR, Karlsruhe, Germany

perfluorododecanoic acid

PFDoDA

96

Alfa Aesar, Karlsruhe, Germany

2,4,4'-Tribromo[13C6]diphenyl ether

MBDE28

>98

Wellington, Guelph, Canada

2,2',4,4'-Tetrabromo[13C6]diphenyl ether

MBDE47

>98

Wellington, Guelph, Canada

2,2',4,4',5-Pentabromo[13C6]diphenyl ether

MBDE99

>98

Wellington, Guelph, Canada

2,2',4,4',5,5'-Hexabromo[13C6]diphenyl ether

MBDE153

>98

Wellington, Guelph, Canada

2,2',3,4,4',5',6-Heptabromo[13C6]diphenyl ether

MBDE183

>98

Wellington, Guelph, Canada

Decabromo[13C6]diphenyl ether

MBDE209

>98

Wellington Guelph, Canada

2,4,4'-Tribromodiphenyl ether

BDE28

>98

Wellington, Guelph, Canada

2,2',4,4'-Tetrabromodiphenyl ether

BDE47

>98

Wellington, Guelph, Canada

2,2',4,4',5-Pentabromodiphenyl ether

BDE99

>98

Wellington , Guelph, Canada

2,2',4,4',6-Pentabromodiphenyl ether

BDE100

>98

Wellington , Guelph, Canada

2,2',4,4',5,5'-Hexabromodiphenyl ether

BDE153

>98

Wellington , Guelph, Canada

2,2',4,4',5,6'-Hexabromodiphenyl ether

BDE154

>98

Wellington , Guelph, Canada

2,2',3,4,4',5',6-Heptabromodiphenyl ether

BDE183

>98

Wellington , Guelph, Canada

Decabromodiphenyl ether

BDE209

>98

Wellington , Guelph, Canada

Fluoranthene-d10

Fluoranthene D10

>98

Dr. Ehrenstorfer, Augsburg, Germany

1-tert-Buthyl-3,5-dimethyl-2,4,6-trinitrobenzene

MX

>99

Ehrenstorfer, Augsburg, Germany

1-tert.-butyl-3,5-dimethyl-2,6-dinitro-4-acetyl-benzene

MK

98

Dr. Ehrenstorfer, Augsburg, Germany

Musk xylene D15

MX D15

>97

Dr. Ehrenstorfer, Augsburg, Germany

7-Acetyl-1,1,3,4,4,6-hexamethyl-1,2,3,4-Tetrahydronaphthalene

AHTN D3

99

Dr. Ehrenstorfer, Augsburg, Germany

7-Acetyl-1,1,3,4,4,6-hexamethyl-1,2,3,4- Tetrahydronaphthalene

AHTN

98

Dr. Ehrenstorfer, Augsburg, Germany

5-Acetyl-1,1,2,6-tetrametyl-3-isopropyl-dihydroindene

ATII

98

Dr. Ehrenstorfer, Augsburg, Germany

4-acetyl-1,1-dimethyl-6-tert-butylindane

ADBI

98

Dr. Ehrenstorfer, Augsburg, Germany

6-acetyl-1,1,2,3,3,5-hexamethylindane

AHMI

98

Dr. Ehrenstorfer, Augsburg, Germany

1,3,4,6,7,8-Hexahydro-4,6,6,7,8,8-hexamethylcyclopenta-(γ)-2-benzopyran

HHCB

51

Dr. Ehrenstorfer, Augsburg, Germany

hexane

-

picograde

Promochem, Wesel, Germany

ethyl acetate

-

picograde

Promochem, Wesel, Germany

acetone

-

picograde

Promochem, Wesel, Germany

methyl-tert-butylether

MTBE

picograde

Promochem, Wesel, Germany

methanol

MeOH

residual analysis

J.T. Baker, Griesheim, Germany

Helium

-

5.0

Air Liquide, Krefeld, Germany

nitrogen

-

5.0

Air Liquide, Krefeld, Germany

methane

-

5.0

Air Liquide, Krefeld, Germany



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