Diisopentyl phthalate

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

ID: Reference8771

Other Names: Disoamyl phthalate;
Isoamyl phthalate;
1,2-Benzenedicarboxylic acid 1,2-bis(3-methylbutyl) ester;
1,2-Benzenedicarboxylic acid, bis(3-methylbutyl) ester;
3-Methylbutyl 2-[(3-methylbutyl)oxycarbonyl]benzoate ; more

Formula: C18H26O4

Class: Extractables/Leachables Textile Chemicals/Auxiliary/Dyes

Spectral Data

Diisopentyl 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 653
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/2/2019 2:14:42 PM
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Identificators

InChI InChI=1S/C18H26O4/c1-13(2)9-11-21-17(19)15-7-5-6-8-16(15)18(20)22-12-10-14(3)4/h5-8,13-14H,9-12H2,1-4H3
InChI Key JANBFCARANRIKJ-UHFFFAOYSA-N
Canonical SMILES CC(C)CCOC(=O)C1=CC=CC=C1C(=O)OCCC(C)C
CAS 605505
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Other Names Disoamyl phthalate;
Isoamyl phthalate;
1,2-Benzenedicarboxylic acid 1,2-bis(3-methylbutyl) ester;
1,2-Benzenedicarboxylic acid, bis(3-methylbutyl) ester;
3-Methylbutyl 2-[(3-methylbutyl)oxycarbonyl]benzoate;
Bis(3-methylbutyl) phthalate;
Phthalic acid diisopentyl ester;
Phthalic acid, bis-isopentyl ester;
Phthalic acid, diisopentyl ester;
DIPP

In Other Databases

WebBook 859574714
PubChem 69059
ChemIDPlus 605505
ChemSpider 62280
Wikipedia Diisopentylphthalat (DE)