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O-ACETYL-5-PHENYL-GAMMA-TOCOPHEROL
SpectraBase Compound ID Cvr6yYua4eX
InChI InChI=1S/C36H54O3/c1-25(2)15-12-16-26(3)17-13-18-27(4)19-14-23-36(8)24-22-32-33(31-20-10-9-11-21-31)35(38-30(7)37)29(6)28(5)34(32)39-36/h9-11,20-21,25-27H,12-19,22-24H2,1-8H3/t26-,27-,36-/m1/s1
InChIKey VZRWKGFFWPXKPD-XUJRGEPCSA-N
Mol Weight 534.8 g/mol
Molecular Formula C36H54O3
Exact Mass 534.407296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6RhO1IvqO0k
Name O-ACETYL-5-PHENYL-GAMMA-TOCOPHEROL
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H54O3
InChI InChI=1S/C36H54O3/c1-25(2)15-12-16-26(3)17-13-18-27(4)19-14-23-36(8)24-22-32-33(31-20-10-9-11-21-31)35(38-30(7)37)29(6)28(5)34(32)39-36/h9-11,20-21,25-27H,12-19,22-24H2,1-8H3/t26-,27-,36-/m1/s1
InChIKey VZRWKGFFWPXKPD-XUJRGEPCSA-N
Literature Reference Author E.KLOSER,S.BOEHMDORFER,L.BRECKER,H.KAEHLING,T.NETSCHER,K.MER EITER,T.ROSENAU
Literature Reference Citation EUR.J.ORG.CHEM.,2011,2450(2011)
Literature Reference DOI 10.1002/ejoc.201100178
Molecular Weight 534.823 g/mol
Solvent CDCl3
Source File Reference UWBT21041