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Gamma-tocopherol

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 2 MS (GC)

Gamma-tocopherol
SpectraBase Compound ID LP0e0LxZPeg
InChI InChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h19-22,29H,8-18H2,1-7H3/t21-,22-,28-/m1/s1
InChIKey QUEDXNHFTDJVIY-DQCZWYHMSA-N
Mol Weight 416.7 g/mol
Molecular Formula C28H48O2
Exact Mass 416.365431 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KcQOkHFwPFy
Name Gamma-tocopherol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.365430784 u
Formula C28H48O2
InChI InChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h19-22,29H,8-18H2,1-7H3/t21-,22-,28-/m1/s1
InChIKey QUEDXNHFTDJVIY-DQCZWYHMSA-N
Molecular Weight 416.690 g/mol
SMILES OC1=C(C(=C2O[C@@](CCC2=C1)(CCC[C@@](CCC[C@@](CCCC(C)C)(C)[H])(C)[H])C)C)C
Spectrum/Structure Validation Score (Raman) 0.974211