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1,4-Diethylhexyl cyclopentanecarboxylate
SpectraBase Compound ID 6ThcV8IXav6
InChI InChI=1S/C16H30O2/c1-4-13(5-2)11-12-15(6-3)18-16(17)14-9-7-8-10-14/h13-15H,4-12H2,1-3H3
InChIKey HIAADUAWVLLYOZ-UHFFFAOYSA-N
Mol Weight 254.41 g/mol
Molecular Formula C16H30O2
Exact Mass 254.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYBkSH29cIX
Name 1,4-Diethylhexyl cyclopentanecarboxylate
Alternate Name(s) Cyclopentanecarboxylic acid, 6-ethyl-3-octyl ester cyclopentanecarboxylic acid 6-ethyloctan-3-yl ester 6-Ethyloctan-3-yl cyclopentanecarboxylate
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Formula C16H30O2
InChI InChI=1S/C16H30O2/c1-4-13(5-2)11-12-15(6-3)18-16(17)14-9-7-8-10-14/h13-15H,4-12H2,1-3H3
InChIKey HIAADUAWVLLYOZ-UHFFFAOYSA-N
Molecular Weight 254.414 g/mol
SMILES C1CCC(C1)C(OC(CC)CCC(CC)CC)=O
SPLASH splash10-00kb-9100000000-3de0fddf06f95efbf986
Source of Spectrum NP-7-3697-0
Wiley ID 1106477