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di(t-Butyl) 2-[indane-1',3'-dione-2'-yl-2'-ylide]-3-pyridinium-1,4-butanedioate
SpectraBase Compound ID LA4tHhXXjLH
InChI InChI=1S/C26H29NO6/c1-25(2,3)32-23(30)18(19-21(28)16-12-8-9-13-17(16)22(19)29)20(24(31)33-26(4,5)6)27-14-10-7-11-15-27/h7-15,18,20H,1-6H3
InChIKey OVEBEHQRZFVSHF-UHFFFAOYSA-N
Mol Weight 451.52 g/mol
Molecular Formula C26H29NO6
Exact Mass 451.199488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8CUEwtvHtc
Name di(t-Butyl) 2-[indane-1',3'-dione-2'-yl-2'-ylide]-3-pyridinium-1,4-butanedioate
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Formula C26H29NO6
InChI InChI=1S/C26H29NO6/c1-25(2,3)32-23(30)18(19-21(28)16-12-8-9-13-17(16)22(19)29)20(24(31)33-26(4,5)6)27-14-10-7-11-15-27/h7-15,18,20H,1-6H3
InChIKey OVEBEHQRZFVSHF-UHFFFAOYSA-N
Molecular Weight 451.519 g/mol
SMILES [C-]1(C(C(OC(C)(C)C)=O)C(C(OC(C)(C)C)=O)[n+]2ccccc2)C(c2ccccc2C1=O)=O
SPLASH splash10-0a6r-9120000000-aa224c30fcc680b9809d
Source of Spectrum AH-133-1335-8
Synonyms 2-[1,4-bis[(2-methylpropan-2-yl)oxy]-1,4-dioxo-3-(1-pyridin-1-iumyl)butan-2-yl]-3-oxo-1-indenolate 2-[1,4-bis[(2-methylpropan-2-yl)oxy]-1,4-dioxo-3-pyridin-1-ium-1-ylbutan-2-yl]-3-oxoinden-1-olate 2-(3-tert-butoxy-1-tert-butoxycarbonyl-3-oxo-2-pyridin-1-ium-1-yl-propyl)-3-oxo-inden-1-olate 2-[1,4-bis[(2-methylpropan-2-yl)oxy]-1,4-bis(oxidanylidene)-3-pyridin-1-ium-1-yl-butan-2-yl]-3-oxidanylidene-inden-1-olate
Wiley ID 1546746