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5-Tert-butoxycarbonyloxy-isophthalic acid diethyl ester
SpectraBase Compound ID Eg22mOmouEv
InChI InChI=1S/C17H22O7/c1-6-21-14(18)11-8-12(15(19)22-7-2)10-13(9-11)23-16(20)24-17(3,4)5/h8-10H,6-7H2,1-5H3
InChIKey PSJYWKCWCXYFFS-UHFFFAOYSA-N
Mol Weight 338.36 g/mol
Molecular Formula C17H22O7
Exact Mass 338.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TuNLFtVVnb
Name 5-Tert-butoxycarbonyloxy-isophthalic acid diethyl ester
Alternate Name(s) Diethyl 5-((tert-butoxycarbonyl)oxy)isophthalate 5-[(2-methylpropan-2-yl)oxy-oxomethoxy]benzene-1,3-dicarboxylic acid diethyl ester Diethyl 5-tert-butoxycarbonyloxybenzene-1,3-dicarboxylate Diethyl 5-[(2-methylpropan-2-yl)oxycarbonyloxy]benzene-1,3-dicarboxylate
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Formula C17H22O7
InChI InChI=1S/C17H22O7/c1-6-21-14(18)11-8-12(15(19)22-7-2)10-13(9-11)23-16(20)24-17(3,4)5/h8-10H,6-7H2,1-5H3
InChIKey PSJYWKCWCXYFFS-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol0625536
Molecular Weight 338.356 g/mol
SMILES c1c(OC(=O)OC(C)(C)C)cc(cc1C(=O)OCC)C(OCC)=O
SPLASH splash10-0a4l-9310000000-0c05748c856536cc953b
Source of Spectrum A1-8-5673/SM25-arb5
Wiley ID 1760995