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Propanoic acid, 2-methyl-, 2-ethyl-1-propyl-1,3-propanediyl ester
SpectraBase Compound ID 2lvLZMwPxXY
InChI InChI=1S/C16H30O4/c1-7-9-14(20-16(18)12(5)6)13(8-2)10-19-15(17)11(3)4/h11-14H,7-10H2,1-6H3
InChIKey VQMFIHQBOYTCJD-UHFFFAOYSA-N
Mol Weight 286.41 g/mol
Molecular Formula C16H30O4
Exact Mass 286.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVCp27onXCq
Name Propanoic acid, 2-methyl-, 2-ethyl-1-propyl-1,3-propanediyl ester
Alternate Name(s) 2-Ethyl-3-(isobutyryloxy)hexyl 2-methylpropanoate 2-Methylpropionic acid (2-ethyl-3-isobutyryloxy-hexyl) ester 2-Methylpropanoic acid [2-ethyl-3-(2-methyl-1-oxopropoxy)hexyl] ester
CAS Registry Number 74367-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H30O4
InChI InChI=1S/C16H30O4/c1-7-9-14(20-16(18)12(5)6)13(8-2)10-19-15(17)11(3)4/h11-14H,7-10H2,1-6H3
InChIKey VQMFIHQBOYTCJD-UHFFFAOYSA-N
Molecular Weight 286.412 g/mol
SMILES C(C(OC(C(C)C)=O)CCC)(COC(C(C)C)=O)CC
SPLASH splash10-0006-9000000000-9ada264a1dad8cca3bb8
Source of Spectrum Va-0-0-0
Wiley ID 740855