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Decanoic acid, 2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl ester
SpectraBase Compound ID AkodVaHdr3L
InChI InChI=1S/C45H84O8/c1-5-9-13-17-21-25-29-33-41(46)50-37-45(38-51-42(47)34-30-26-22-18-14-10-6-2,39-52-43(48)35-31-27-23-19-15-11-7-3)40-53-44(49)36-32-28-24-20-16-12-8-4/h5-40H2,1-4H3
InChIKey MXNODNKXIIQMMI-UHFFFAOYSA-N
Mol Weight 753.2 g/mol
Molecular Formula C45H84O8
Exact Mass 752.61662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYfuUWpXXhB
Name Decanoic acid, 2,2-bis[[(1-oxodecyl)oxy]methyl]-1,3-propanediyl ester
Alternate Name(s) 3-(Decanoyloxy)-2,2-bis[(decanoyloxy)methyl]propyl decanoate 2,2-bis(((1-oxodecyl)oxy)methyl)-1,3-propanediyl didecanoate 2,2-Bis(hydroxymethyl)-propane-1,3-diol tetrasdecanoate Decanoic acid, neopentanetetrayl ester Pentaerythritol tetracaprate Pentaerythritol tetradecanoate Pentaerythritol, tetrakis(decanoate) decanoic acid [3-(1-oxodecoxy)-2,2-bis(1-oxodecoxymethyl)propyl] ester [3-decanoyloxy-2,2-bis(decanoyloxymethyl)propyl] decanoate EINECS 237-441-5
CAS Registry Number 13784-61-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H84O8
InChI InChI=1S/C45H84O8/c1-5-9-13-17-21-25-29-33-41(46)50-37-45(38-51-42(47)34-30-26-22-18-14-10-6-2,39-52-43(48)35-31-27-23-19-15-11-7-3)40-53-44(49)36-32-28-24-20-16-12-8-4/h5-40H2,1-4H3
InChIKey MXNODNKXIIQMMI-UHFFFAOYSA-N
Molecular Weight 753.159 g/mol
SMILES C(=O)(OCC(COC(=O)CCCCCCCCC)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC)CCCCCCCCC
SPLASH splash10-057i-6383970000-79eaf38506859a0e4199
Source of Spectrum O-13-250-1
Wiley ID 1416379