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dl-alpha-Tocopherol acetate

View entire compound with spectra: 5 NMR, 4 FTIR, 2 Raman, and 9 MS (GC)

dl-alpha-Tocopherol acetate
SpectraBase Compound ID IHfkXVwpS9m
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/t22-,23-,31-/m1/s1
InChIKey ZAKOWWREFLAJOT-CEFNRUSXSA-N
Mol Weight 472.8 g/mol
Molecular Formula C31H52O3
Exact Mass 472.391646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70RmTBDzLYW
Name 2,5,7,8-TETRAMETHYL-2-(4,8,12-TRIMETHYLTRIDECYL)-6-CHROMANOL, ACETATE
Source of Sample Fluka AG, Buchs, Switzerland
Boiling Point 224C/0.3mm
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2025 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/t22-,23-,31-/m1/s1
InChIKey ZAKOWWREFLAJOT-CEFNRUSXSA-N
Molecular Weight 472.76
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms VITAMIN E, ACETATE A-TOCOPHEROL, ACETATE 6-CHROMANOL, 2,5,7,8-TETRAMETHYL-2- /4,8,12-TRIMETHYLTRIDECYL/-, ACETATE