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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 nfJouQpxBB
Name Hexanoic acid, ethyl ester
CAS Registry Number 123-66-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 splash10-007d-9100000000-2215096111d369e55329
Source of Spectrum UT-1990-1044-0
Synonyms 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
Wiley ID 152757