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. 2014 Dec 16;16(3):664–674. doi: 10.1208/s12249-014-0249-x

Table VII.

Reflux Extractables Levels in Unprocessed PVC (GC/MS). All are Identified Compounds Against Retention Time and MS Library or Analytical Standard, Except for Starred Entries. Concentrations (g/g) are Reported Based on a Response Factor from a Surrogate Standard

Identified compounds CAS no. Reflux with IPA Reflux with hexane Reflux with pH 9.5
6–10 h 6–10 h 24 h
Di-2-ethylhexyl phthalate (DEHP) 117-81-7 67,000 56,000 40
(Z)-13-Docosenamide (erucamide) 112-84-5 4300 820 3.9
Tetradecanoic acid (myristic acid) 544-63-8 ND ND 1.3
Hexadecanoic acid (palmitic acid) 57-10-3 21 NDc 3.7
2-ethyl hexanol 104-76-7 17 7.5 4.7
Nonanal 124-19-6 1.6 1.6 NDd
Phthalic acid 88-99-3 1 1.3 4.3
2,6-bis(1,1-dimethylethyl)-4-methyl-phenol (BHT) 128-37-0 17 15 ND
Benzoic acid, 2-ethylhexyl estera 5444-75-7 27 27 ND
2-Pentadecanone, 6,10,14-trimethyl- b 502-69-2 1.8 1.6 ND
Isopropyl palmitate 142-91-6 51 ND ND
Methyl palmitate 112-39-0 ND 1.9 ND
iso-Propyl octadecanoatea 112-10-7 21 ND ND
Tributylacetylcitrate 77-90-7 ND 4.8 ND
Stearic acid, 9,10-epoxy-, isopropyl esterb 95007-80-0 70 ND ND
Docosanamide 3061-75-4 110 23 ND
-Sitosterol acetate 915-05-9 5.1 4.6 ND
Tris(2-ethylhexyl) trimellitate 3319-31-1 9.6 5.4 ND
Hexanoic acid 142-62-1 ND ND 0.32
Nonanoic acid 112-05-0 ND ND 1.2
Dodecanoic acid 143-07-7 ND ND 0.46
Octadecanoic acid (stearic acid) 57-11-4 ND ND 0.82

aMost probable compound—mass spectrum matches a library or literature spectrum and the presence of the compound is confirmed by data provided by the sponsor or material supplier

bTentatively identified compound—data have been obtained that are consistent with a class of molecule only. Or, the mass spectrum matches a library or literature spectrum

cMethyl palmitate detected in profile

dNonanoic acid detected in profile

ND not detected