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delta-Acetoxyoctanic acid-ethylester
SpectraBase Compound ID AOD4vYSVgtH
InChI InChI=1S/C12H22O4/c1-4-7-11(16-10(3)13)8-6-9-12(14)15-5-2/h11H,4-9H2,1-3H3
InChIKey PZSMEJQENCSIPM-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wg9PYPQYNi
Name Octanoic acid, 5-(acetyloxy)-, ethyl ester
Alternate Name(s) Ethyl 5-(acetyloxy)octanoate 5-Acetoxycaprylic acid ethyl ester 5-Acetyloxyoctanoic acid ethyl ester Ethyl 5-acetoxyoctanoate
CAS Registry Number 35234-25-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-4-7-11(16-10(3)13)8-6-9-12(14)15-5-2/h11H,4-9H2,1-3H3
InChIKey PZSMEJQENCSIPM-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES C(=O)(OC(CCC)CCCC(=O)OCC)C
SPLASH splash10-0006-9300000000-01eb442b449aaec4ebae
Source of Spectrum H-54-1886-7
Wiley ID 1231624