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TOCOQUINONE;3,4,5-TRIMETHYL-2-(3-HYDROXY-3,7,11,15-TETRAMETHYL-HEXADECAN-1-YL)-PARA-BENZOQUINONE
SpectraBase Compound ID 2cjnmkEnOTN
InChI InChI=1S/C33H50O3/c1-23(2)13-10-14-24(3)15-11-16-25(4)17-12-18-26(5)19-21-33(9,36)22-20-30-29(8)31(34)27(6)28(7)32(30)35/h13,15,17,19,36H,10-12,14,16,18,20-22H2,1-9H3/b24-15+,25-17+,26-19+
InChIKey IDNXZMQVABYJHO-QGBZOTKOSA-N
Mol Weight 494.8 g/mol
Molecular Formula C33H50O3
Exact Mass 494.375995 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1pUSSAiWq0n
Name TOCOQUINONE;3,4,5-TRIMETHYL-2-(3-HYDROXY-3,7,11,15-TETRAMETHYL-HEXADECAN-1-YL)-PARA-BENZOQUINONE
Compound Number Q
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H50O3
InChI InChI=1S/C33H50O3/c1-23(2)13-10-14-24(3)15-11-16-25(4)17-12-18-26(5)19-21-33(9,36)22-20-30-29(8)31(34)27(6)28(7)32(30)35/h13,15,17,19,36H,10-12,14,16,18,20-22H2,1-9H3/b24-15+,25-17+,26-19+
InChIKey IDNXZMQVABYJHO-QGBZOTKOSA-N
Literature Reference Author C.GIACOMELLI,F.C.GIACOMELLI,L.O.ALVES,A.K.TIMBOLA,A.SPINELLI
Literature Reference Citation J.BRAZ.CHEM.SOC.,15,748(2004)
Literature Reference DOI 10.1590/s0103-50532004000500022
Molecular Weight 494.758 g/mol
Solvent ACETONE-D6
Source File Reference UWLU7057