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Hexanoic acid ethyl ester
SpectraBase Compound ID mbtA9bTnjR
InChI InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChIKey SHZIWNPUGXLXDT-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21OqvqPHYe
Name Hexanoic acid, ethyl ester
Alternate Name(s) Acetic acid, butyl-, ethyl ester Caproic acid ethyl ester Capronic ether absolute Ethyl butyl acetate Ethyl caproate Ethyl ester of hexanoic acid Ethyl hexanoate Ethyl hexanoate (caproate) Ethyl hexoate Ethyl n-hexanoate Hexanoic acid ethyl ester Hexanoic acid, ethyl ester, mixt. with soybean oil epoxide n-Caproic acid ethyl ester AI3-15347 BRN 1701293 CCRIS 6555 EINECS 204-640-3 FEMA NO. 2439 NSC 8882
CAS Registry Number 123-66-0
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Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChIKey SHZIWNPUGXLXDT-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
SMILES C(=O)(OCC)CCCCC
SPLASH splash10-000f-9000000000-b23a61e977dd3bcd44d6
Source of Spectrum LQ-1992-1685-0
Wiley ID 1142646