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Vitamin E acetate

View entire compound with spectra: 4 NMR, 3 FTIR, 1 Raman, and 9 MS (GC)

Vitamin E 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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1g2v5fVfzZ8
Name 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, [2R-[2R*(4R*,8R*)]]-
CAS Registry Number 58-95-7
Classification Vitamin E compounds
Comments Generally Recognized as Safe; NTIS Accession Number: PB262653
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 472.391645531 u
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 472.754 g/mol
Number of Peaks 83
SMILES c12c(c(C)c(c(c2C)C)OC(=O)C)CC[C@](O1)(CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])C
SPLASH splash10-00lr-4910700000-939d3e5118862e59446b
Source of Spectrum W-18-512-16
Synonyms (2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl acetate 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl acetate (+)-.alpha.-Tocopherol acetate (+)-.alpha.-Tocopheryl acetate (2R,4'R,8'R)-.alpha.-Tocopheryl acetate (R,R,R)-.alpha.-Tocopheryl acetate .alpha.-Tocopherol acetate 2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate .alpha.-Tocopheryl acetate 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-6-cromanyl acetate, (+)- 2H-1-benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)-, acetate, (2R)- 2H-1-benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (2R-(2*(4R*,8R*)))- 3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl acetate, (2R-(2*(4R*,8R*)))- dl-.alpha.-Tocopherol acetate 6-Chromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (+)- dl-.alpha.-Tocopheryl acetate 6-Cromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-, acetate, (+)- Alfacol Combinal E Contopheron D-.alpha.-tocopherol acetate Vitamin E acetate D-.alpha.-Tocopheryl acetate d-Vitamin E acetate E-Ferol E-Toplex E-vicotrat Acetic acid [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-1-benzopyran-6-yl] ester Ecofrol [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] acetate Econ [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]chroman-6-yl] acetate Endo E Dompe [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] ethanoate Ephynal acetate Epsilan-M Erevit Evipherol Fertilvit Gevex Juvela Spondyvit Tocopherex Tocopheryl acetate Tocophrin Tofaxin Tokoferol acetate Vitamin E acetate, D- Vitamin Ealpha acetate CCRIS 4389 COPHEROL 1250 COVITOL 1100 COVITOL 1360 EINECS 200-405-4
Wiley ID 61905