Hexyl octyl phthalate

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Systematic / IUPAC Name: 1-O-Hexyl 2-O-octyl benzene-1,2-dicarboxylate

ID: Reference8772

Other Names: 1,2-Benzenedicarboxylic acid hexyl octyl ester;
1,2-Benzenedicarboxylic acid, hexyl octyl ester;
1,2-Benzenedicarboxylicacid, 1-hexyl 2-octyl ester;
Phthalic acid hexyl octyl ester;
Phthalic acid, hexyl octyl ester

Formula: C22H34O4

Class: Extractables/Leachables

Spectral Data

Hexyl octyl phthalate 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 Orbitrap Fusion with FAIMS
No. of Spectral Trees 1
No. of Spectra 310
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 4/3/2019 10:23:56 AM
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Identificators

InChI InChI=1S/C22H34O4/c1-3-5-7-9-10-14-18-26-22(24)20-16-12-11-15-19(20)21(23)25-17-13-8-6-4-2/h11-12,15-16H,3-10,13-14,17-18H2,1-2H3
InChI Key LZCTXAGBGKLUBX-UHFFFAOYSA-N
Canonical SMILES CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC
CAS 61827621
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Other Names 1,2-Benzenedicarboxylic acid hexyl octyl ester;
1,2-Benzenedicarboxylic acid, hexyl octyl ester;
1,2-Benzenedicarboxylicacid, 1-hexyl 2-octyl ester;
Phthalic acid hexyl octyl ester;
Phthalic acid, hexyl octyl ester

In Other Databases

PubChem 112746
ChemIDPlus 61827621
ChemSpider 101053