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Monoisooctyladipate
SpectraBase Compound ID 6cTjASKsT1w
InChI InChI=1S/C14H26O4/c1-3-5-8-12(4-2)11-18-14(17)10-7-6-9-13(15)16/h12H,3-11H2,1-2H3,(H,15,16)
InChIKey MBGYSHXGENGTBP-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bbar7tsAm0
Name 6-[(2-Ethylhexyl)oxy]-6-oxohexanoic acid
Alternate Name(s) 2-Ethylhexyl hydrogen adipate 6-(2-Ethylhexoxy)-6-keto-hexanoic acid 6-(2-Ethylhexoxy)-6-oxidanylidene-hexanoic acid 6-(2-Ethylhexoxy)-6-oxo-hexanoic acid Hexanedioic acid, mono(2-ethylhexyl)ester Mono-2-ethylhexyl adipate CCRIS 4296 EINECS 224-386-7
CAS Registry Number 4337-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-3-5-8-12(4-2)11-18-14(17)10-7-6-9-13(15)16/h12H,3-11H2,1-2H3,(H,15,16)
InChIKey MBGYSHXGENGTBP-UHFFFAOYSA-N
Molecular Weight 258.358 g/mol
SMILES OC(CCCCC(=O)OCC(CC)CCCC)=O
SPLASH splash10-0729-9800000000-93cc3e927f02216b78cd
Source of Spectrum BW-0-0-39364
Wiley ID 1261708