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1,4-Diethylhexyl pentanoate
SpectraBase Compound ID Ftl8bK6ezHb
InChI InChI=1S/C15H30O2/c1-5-9-10-15(16)17-14(8-4)12-11-13(6-2)7-3/h13-14H,5-12H2,1-4H3
InChIKey NOJXOPLFXAGBSY-UHFFFAOYSA-N
Mol Weight 242.4 g/mol
Molecular Formula C15H30O2
Exact Mass 242.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hbfa9LtT4Xt
Name 1,4-Diethylhexyl pentanoate
Alternate Name(s) Pentanoic acid, 6-ethyl-3-octyl ester Pentanoic acid 6-ethyloctan-3-yl ester 6-Ethyloctan-3-yl pentanoate
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Formula C15H30O2
InChI InChI=1S/C15H30O2/c1-5-9-10-15(16)17-14(8-4)12-11-13(6-2)7-3/h13-14H,5-12H2,1-4H3
InChIKey NOJXOPLFXAGBSY-UHFFFAOYSA-N
Molecular Weight 242.403 g/mol
SMILES CCCCC(OC(CCC(CC)CC)CC)=O
SPLASH splash10-000i-9100000000-75da7471a2dbb0029f0e
Source of Spectrum NP-6-6524-0
Wiley ID 1105872