For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
alpha-Tocopherylquinone
SpectraBase Compound ID Lp1cyxCJw85
InChI InChI=1S/C29H50O3/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8,32)19-17-26-25(7)27(30)23(5)24(6)28(26)31/h20-22,32H,9-19H2,1-8H3
InChIKey LTVDFSLWFKLJDQ-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C29H50O3
Exact Mass 446.375995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Hq6K0oecFkj
Name .alpha.-Tocopherolquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H50O3
InChI InChI=1S/C29H50O3/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8,32)19-17-26-25(7)27(30)23(5)24(6)28(26)31/h20-22,32H,9-19H2,1-8H3
InChIKey LTVDFSLWFKLJDQ-UHFFFAOYSA-N
Molecular Weight 446.716 g/mol
SMILES OC(CCC1=C(C(=O)C(=C(C1=O)C)C)C)(CCCC(CCCC(CCCC(C)C)C)C)C
SPLASH splash10-002b-0520900000-47c29696b98a2588baa1
Source of Spectrum F-51-7924-6
Synonyms 2,3,5-trimethyl-6-(3,7,11,15-tetramethyl-3-oxidanyl-hexadecyl)cyclohexa-2,5-diene-1,4-dione 2-(3-hydroxy-3,7,11,15-tetramethyl-hexadecyl)-3,5,6-trimethyl-1,4-benzoquinone 2-(3-hydroxy-3,7,11,15-tetramethyl-hexadecyl)-3,5,6-trimethyl-p-benzoquinone 2-(3-hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione
Wiley ID 792632