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alpha-Tocopherol AC
SpectraBase Compound ID FOw6rL7SMRp
InChI InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3
InChIKey ZAKOWWREFLAJOT-UHFFFAOYSA-N
Mol Weight 472.8 g/mol
Molecular Formula C31H52O3
Exact Mass 472.391646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxN6DAZd4H1
Name tocopherol acetate
Alternate Name(s) Vitamin E acetate Contopheron Tocopherex Evipherol Fertilvit Tocophrin [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] acetate 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl acetate
Comments CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001060
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H52O3
InChI InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3
InChIKey ZAKOWWREFLAJOT-UHFFFAOYSA-N
Molecular Weight 472.754 g/mol
SMILES CC(C)CCCC(C)CCCC(C)CCCC1(C)CCc2c(C)c(c(C)c(C)c2O1)OC(C)=O
SPLASH splash10-014i-0910200000-819205321bef0c8e5662
Source of Spectrum FM-2019-1060-0
Wiley ID 1818718