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Bis(2-ethylhexyl) phthalate
SpectraBase Compound ID 1pQLpwQhfdH
InChI InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3
InChIKey BJQHLKABXJIVAM-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4C0LPEX9Fap
Name Bis(2-ethylhexyl) phthalate
Source of Sample Sigma-Aldrich Cat. #36735
CAS Registry Number 117-81-7
Classification Pesticides
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Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3
InChIKey BJQHLKABXJIVAM-UHFFFAOYSA-N
Number of Peaks 167
RI1 2531
SMILES c1(c(C(OCC(CC)CCCC)=O)cccc1)C(OCC(CC)CCCC)=O
SPLASH splash10-0002-7900000000-4669b778677cc5a6202e
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,2-Benzenedicarboxylic acid, 1,2-bis(2-ethylhexyl) ester
Wiley ID LM_PEST_806