PEG Diethylhexanoate n12

Systematic / IUPAC Name:

ID: Reference5472

Other Names: PEG Bis ethyl hexanoate n12 ;
PEG Bis(2-ethylhexanoate) n12

Formula: C40H78O15

Class: Extractables/Leachables Industrial Chemicals

Spectral Data

PEG Diethylhexanoate n12 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 157
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/8/2019 1:25:22 PM
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Identificators

InChI InChI=1S/C40H78O15/c1-5-9-11-37(7-3)39(41)54-35-33-52-31-29-50-27-25-48-23-21-46-19-17-44-15-13-43-14-16-45-18-20-47-22-24-49-26-28-51-30-32-53-34-36-55-40(42)38(8-4)12-10-6-2/h37-38H,5-36H2,1-4H3
InChI Key YHLFKQPSBXFZPJ-UHFFFAOYSA-N
Canonical SMILES CCCCC(C(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C(CCCC)CC)CC
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Other Names PEG Bis ethyl hexanoate n12 ;
PEG Bis(2-ethylhexanoate) n12

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