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Page 1 OF 4
Source of Unknown
(2M+H)
+
Acetonitrile d6-DMSO
+
(M+Cu)
(2M+Na)
DMSO tris, tris(hydroxymethyl)aminomethane dimethylaminopyridine (DMAP) diisopropylethyl amine (DIPEA) DMSO tripropylamine (TPA) acetonitrile acetonitrile phthalic anhydride phenyldiethylamine 1,8-diazabicyclo[5.4.0]undec-7-ene (DBU)
(M+CH3CN+NH4)+
+ + +
+ + +
(2M+H)
DMSO sodium trifluoroacetate dimethyl phthalate dioctyl phthalate d6-DMSO phthalic anhydride DMSO tributylamine dimethyl phthalate n-butyl benzenesulfonamide (plastisizer) dicyclohexyl urea (DCU) n-butyl benzenesulfonamide (plastisizer) n-butyl benzenesulfonamide (plastisizer)
+
(M+Na)
(2M+Na)
(M+NH3)+ (M+Na) M
+ +
[(M.HCl)2-Cl]
Rev. A
Page 2 OF 4
Ion M
+ +
Compound trityl cation DMSO tributylphosphate monomethoxytrityl cation (MMT) triphenylphosphine oxide dibutylphthalate (plasticiser)
Source of Unknown
(3M+H) M M M
+ + + + + +
(M+H)+
slip agent in polyethylene films slip agent in polyethylene films anti-static agent slip agent in polyethylene films
dibutylphthalate (plasticiser) oleamide dibutylphthalate (plasticiser) tributyl tin formate erucamide slip agent in polyethylene films siloxane from silica column slip agent in polyethylene films
(M+H)+ (M+H)
+
+ + +
diisooctyl phthalate (plasticiser) unidentified contaminant (plasticiser) diisooctyl phthalate (plasticiser) dodecamethylcyclohexasiloxane dicyclohexyl urea (DCU)
+
seen w/ silica capillary NanoSprayer seen w/ silica capillary NanoSprayer also observed w/ high conc. of formic acid seen w/ silica capillary NanoSprayer
(M+H)+ (2M+H)
+
(M+Na+CH3CN)
(M+H)
tetradecamethylcycloheptasiloxane
seen w/ silica capillary NanoSprayer Derived from rubber tip from disposable syringe plunger
(M+H)
(acetate)n+(Fe)n+
observed w/ high conc. of acetic acid Derived from rubber tip from disposable syringe plunger seen w/ Nunc polypropylene tubes observed w/ high conc. of acetic acid seen w/ Nunc polypropylene tubes seen w/ Vanguard polypropylene tubes hexadecamethylcyclooctasiloxane seen w/ Vanguard polypropylene tubes seen w/ silica capillary NanoSprayer
(M+Na)
Rev. A
Page 3 OF 4
Ion (M+K)
+
Compound
Source of Unknown seen w/ Vanguard polypropylene tubes seen w/ silica capillary NanoSprayer
(M+H) (M+H)
octadecamethylcyclononasiloxane seen w/ new PEEK tubing from purified water and solvent filters seen w/ silica capillary NanoSprayer from purified water and solvent filters from purified water and solvent filters eicosamethylcyclodecasiloxane titanium adduct diisooctyl phthalate (plasticiser) diisooctyl phthalate (plasticiser)
+
(M+Ti)
(2M+NH4) (2M+Na)
Ion CN
-
(HCOO)
(CF3CO2Na)
CH3SO3 HSO4
-
methanesulfonate
H2PO4
sodium trifluoracetate, TFA sodium trifluoracetate, TFA sodium trifluoracetate, TFA sodium trifluoracetate, TFA
ESI+ Clusters
m/z 18 32 41 44 50 53 58 58 63 68 water methanol acetonitrile PEG, HO-(CH2CH2On-H)+ perfluoro, CF2 NH4Cl PPG NaCl NH4Cl salts NaFA salts Compound
Rev. A
Page 4 OF 4
ESI+ Clusters
m/z 72 74 74 77 78 82 136 162 KCl Si(CH3)2O (from rubber) NH4Ac salts DMSO NaAc NaTFA Polysaccharides Compound Replacement of OH by OSi(CH3)3
(M+CH3OH+H) (M+ACN+H)
+ + +
(M+ACN+Na) (M+2ACN+H)
(M+DMSO+H)