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3-[3',5'-di(t-Butyl)-4'-hydroxyphenyl]-5-hydroxy-1,4-naphthoquinone

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

3-[3',5'-di(t-Butyl)-4'-hydroxyphenyl]-5-hydroxy-1,4-naphthoquinone
SpectraBase Compound ID FyQfhJbag08
InChI InChI=1S/C24H26O4/c1-23(2,3)16-10-13(11-17(22(16)28)24(4,5)6)15-12-19(26)14-8-7-9-18(25)20(14)21(15)27/h7-12,25,28H,1-6H3
InChIKey SUXGOVKHIAGYSQ-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LOxqzB5DJOa
Name 3-[3',5'-di(T-Butyl)-4'-hydroxyphenyl]-5-hydroxy-1,4-naphthoquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.183109313 u
Formula C24H26O4
InChI InChI=1S/C24H26O4/c1-23(2,3)16-10-13(11-17(22(16)28)24(4,5)6)15-12-19(26)14-8-7-9-18(25)20(14)21(15)27/h7-12,25,28H,1-6H3
InChIKey SUXGOVKHIAGYSQ-UHFFFAOYSA-N
Molecular Weight 378.468 g/mol
SMILES C=1(C(C=2C(O)=CC=CC2C(C1)=O)=O)C=1C=C(C(C)(C)C)C(=C(C1)C(C)(C)C)O