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(2R,8'S)-7',8'-DIHYDRO-9'-OXO-GAMMA-TOCOTRIENOL
SpectraBase Compound ID 4nz9m3wvrAA
InChI InChI=1S/C27H40O3/c1-19(2)12-13-25(29)21(4)11-7-9-20(3)10-8-15-27(6)16-14-23-18-24(28)17-22(5)26(23)30-27/h10,12,17-18,21,28H,7-9,11,13-16H2,1-6H3/b20-10+/t21-,27+/m0/s1
InChIKey RYPIDQSBZKCZIV-NMHVNUJCSA-N
Mol Weight 412.6 g/mol
Molecular Formula C27H40O3
Exact Mass 412.297745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BuDLuPMTXZH
Name (2R,8'S)-7',8'-DIHYDRO-9'-OXO-GAMMA-TOCOTRIENOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O3
InChI InChI=1S/C27H40O3/c1-19(2)12-13-25(29)21(4)11-7-9-20(3)10-8-15-27(6)16-14-23-18-24(28)17-22(5)26(23)30-27/h10,12,17-18,21,28H,7-9,11,13-16H2,1-6H3/b20-10+/t21-,27+/m0/s1
InChIKey RYPIDQSBZKCZIV-NMHVNUJCSA-N
Literature Reference Author M.IWASHIMA,N.TAKO,T.HAYAKAWA,T.MATSUNAGA,J.MORI,H.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,56,124(2008)
Literature Reference DOI 10.1248/cpb.56.124
Molecular Weight 412.613 g/mol
Sample ID 1230
Solvent CDCl3