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2-[3',5'-di(t-Butyl)-4'-hydroxyphenyl]-5-hydroxy-3-methoxy-1,4-naphthoquinone
SpectraBase Compound ID 1bYymu5vVtV
InChI InChI=1S/C25H28O5/c1-24(2,3)15-11-13(12-16(21(15)28)25(4,5)6)18-20(27)14-9-8-10-17(26)19(14)22(29)23(18)30-7/h8-12,26,28H,1-7H3
InChIKey YZCYZVAHXZJNFO-UHFFFAOYSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dABYCQxbUH
Name 2-[3',5'-di(t-Butyl)-4'-hydroxyphenyl]-5-hydroxy-3-methoxy-1,4-naphthoquinone
Alternate Name(s) 2-(3,5-ditert-butyl-4-hydroxyphenyl)-5-hydroxy-3-methoxynaphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-24(2,3)15-11-13(12-16(21(15)28)25(4,5)6)18-20(27)14-9-8-10-17(26)19(14)22(29)23(18)30-7/h8-12,26,28H,1-7H3
InChIKey YZCYZVAHXZJNFO-UHFFFAOYSA-N
Molecular Weight 408.494 g/mol
SMILES Oc1cccc2c1C(C(=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C2=O)OC)=O
SPLASH splash10-0a4i-9004200000-a77a58cb2b8cdada0544
Source of Spectrum D8-325-368-8
Wiley ID 1514457