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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 L5IjBw6Tjgg
Name 6-Acetoxy-3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecan-1-yl)-2h-1-benzopyrane
Comments MONAID: JP010098
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
Ionization Type EI-B
Molecular Weight 472.754 g/mol
SMILES c1(c2c(c(c(c1C)OC(C)=O)C)CCC(C)(O2)CCCC(C)CCCC(C)CCCC(C)C)C
SPLASH splash10-001i-7781900000-567e759a27796c34bafd
Source of Spectrum SRH-2022-10098-0
Wiley ID 1831722