Bis(2-ethylhexyl) isophthalate

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Systematic / IUPAC Name: Bis(2-ethylhexyl) benzene-1,3-dicarboxylate

ID: Reference2735

Other Names: 1,3-Benzenedicarboxylic acid, 1,3-bis(2-ethylhexyl) ester;
1,3-Benzenedicarboxylic acid, bis(2-ethylhexyl) ester;
Bis(2-ethylhexyl) isophthalate;
Di-2-Ethylhexyl isophthalate;
Isophthalic acid, bis(2-ethylhexyl)ester

Formula: C24H38O4

Class: Extractables/Leachables

Spectral Data

Bis(2-ethylhexyl) isophthalate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 118
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/2/2015 2:11:54 PM
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Identificators

InChI InChI=1S/C24H38O4/c1-5-9-12-19(7-3)17-27-23(25)21-14-11-15-22(16-21)24(26)28-18-20(8-4)13-10-6-2/h11,14-16,19-20H,5-10,12-13,17-18H2,1-4H3
InChI Key WXZOXVVKILCOPG-UHFFFAOYSA-N
Canonical SMILES CCCCC(CC)COC(=O)C1=CC(=CC=C1)C(=O)OCC(CC)CCCC
CAS 137893
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Other Names 1,3-Benzenedicarboxylic acid, 1,3-bis(2-ethylhexyl) ester;
1,3-Benzenedicarboxylic acid, bis(2-ethylhexyl) ester;
Bis(2-ethylhexyl) isophthalate;
Di-2-Ethylhexyl isophthalate;
Isophthalic acid, bis(2-ethylhexyl)ester;
DOIP

In Other Databases

ChemIDPlus 000137893
ChemSpider 8405
PubChem 8733