Diisobutyl adipate

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Systematic / IUPAC Name: Bis(2-methylpropyl) hexanedioate

ID: Reference2970

Other Names: DIBA;
Ftaflex DIBA;
Plasthall DIBA;
Adipic acid bis(2-methylpropyl) ester;
Adipic acid diisobutyl ester ; more

Formula: C14H26O4

Class: Extractables/Leachables Excipients/Additives/Colorants Personal Care Products/Cosmetics Textile Chemicals/Auxiliary/Dyes Industrial Chemicals

Spectral Data

Diisobutyl adipate 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 2
No. of Spectra 156
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 3/29/2018 10:00:55 AM
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Identificators

InChI InChI=1S/C14H26O4/c1-11(2)9-17-13(15)7-5-6-8-14(16)18-10-12(3)4/h11-12H,5-10H2,1-4H3
InChI Key RDOFJDLLWVCMRU-UHFFFAOYSA-N
Canonical SMILES CC(C)COC(=O)CCCCC(=O)OCC(C)C
CAS 141048
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Other Names DIBA;
Ftaflex DIBA;
Plasthall DIBA;
Adipic acid bis(2-methylpropyl) ester;
Adipic acid diisobutyl ester;
Di-2-Methylpropyl hexane-1,6-dioate ;
Di-Iso-butyl adipate;
Diisobutyl hexanedioate;
Hexanedioic acid, 1,6-bis(2-methylpropyl) ester;
Hexanedioic acid, bis(2-methylpropyl) ester;
Hexanedioic acid, diisobutyl ester;
Isobutyl adipate

In Other Databases

KEGG C14260
ChemIDPlus 000141048; 068954450
HMDb HMDB41618
ChemSpider 8499
ChEMBL CHEMBL3184260
PubChem 8831