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Eicosanoic acid, 2-phenyl-1,3-dioxan-5-yl ester
SpectraBase Compound ID 6zvQGbS6GGY
InChI InChI=1S/C30H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-29(31)34-28-25-32-30(33-26-28)27-22-19-18-20-23-27/h18-20,22-23,28,30H,2-17,21,24-26H2,1H3
InChIKey PKQIRKZUHHUFAG-UHFFFAOYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C30H50O4
Exact Mass 474.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A6WsZtQHfMC
Name Eicosanoic acid, 2-phenyl-1,3-dioxan-5-yl ester
Alternate Name(s) 2-Phenyl-1,3-dioxan-5-yl icosanoate arachidic acid (2-phenyl-1,3-dioxan-5-yl) ester eicosanoic acid (2-phenyl-1,3-dioxan-5-yl) ester
CAS Registry Number 57156-90-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O4
InChI InChI=1S/C30H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-29(31)34-28-25-32-30(33-26-28)27-22-19-18-20-23-27/h18-20,22-23,28,30H,2-17,21,24-26H2,1H3
InChIKey PKQIRKZUHHUFAG-UHFFFAOYSA-N
Molecular Weight 474.726 g/mol
SMILES CCCCCCCCCCCCCCCCCCCC(=O)OC1COC(c2ccccc2)OC1
SPLASH splash10-0a4i-9600000000-3eacf63acba99c56dce1
Source of Spectrum EP-4808-0-0
Wiley ID 62018