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Acetic acid, trihydroxymethylpropane triester
SpectraBase Compound ID 2QIHHYzBKS8
InChI InChI=1S/C12H20O6/c1-5-12(6-16-9(2)13,7-17-10(3)14)8-18-11(4)15/h5-8H2,1-4H3
InChIKey YTKGRNLQFINUJR-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C12H20O6
Exact Mass 260.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BoLzwVRu4h9
Name 1,3-Propanediol, 2-((acetyloxy)methyl)-2-ethyl-, diacetate
Alternate Name(s) 2,2-bis(acetoxymethyl)butyl acetate 2,2-bis(acetyloxymethyl)butyl acetate 2,2-bis(acetyloxymethyl)butyl ethanoate Acetic acid 2,2-bis(acetoxymethyl)butyl ester Acetic acid 2,2-bis(acetyloxymethyl)butyl ester
CAS Registry Number 10441-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O6
InChI InChI=1S/C12H20O6/c1-5-12(6-16-9(2)13,7-17-10(3)14)8-18-11(4)15/h5-8H2,1-4H3
InChIKey YTKGRNLQFINUJR-UHFFFAOYSA-N
Molecular Weight 260.286 g/mol
SMILES C(COC(=O)C)(COC(=O)C)(COC(=O)C)CC
SPLASH splash10-000f-9300000000-ec2ff019850efac320b0
Source of Spectrum NW-1714-0-0
Wiley ID 1263400