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3-Tert-butoxycarbonyloxy-2-iodo-benzoic acid ethyl ester
SpectraBase Compound ID 7LAPWdFWtvV
InChI InChI=1S/C14H17IO5/c1-5-18-12(16)9-7-6-8-10(11(9)15)19-13(17)20-14(2,3)4/h6-8H,5H2,1-4H3
InChIKey SXXNNPNOIAQWRK-UHFFFAOYSA-N
Mol Weight 392.19 g/mol
Molecular Formula C14H17IO5
Exact Mass 392.012069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1dZJqLwnll
Name 3-Tert-butoxycarbonyloxy-2-iodo-benzoic acid ethyl ester
Alternate Name(s) Ethyl 3-((tert-butoxycarbonyl)oxy)-2-iodobenzoate 2-Iodo-3-[(2-methylpropan-2-yl)oxy-oxomethoxy]benzoic acid ethyl ester Ethyl 2-iodo-3-[(2-methylpropan-2-yl)oxycarbonyloxy]benzoate Ethyl 3-tert-butoxycarbonyloxy-2-iodo-benzoate Ethyl 2-iodanyl-3-[(2-methylpropan-2-yl)oxycarbonyloxy]benzoate
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Formula C14H17IO5
InChI InChI=1S/C14H17IO5/c1-5-18-12(16)9-7-6-8-10(11(9)15)19-13(17)20-14(2,3)4/h6-8H,5H2,1-4H3
InChIKey SXXNNPNOIAQWRK-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol0625536
Molecular Weight 392.189 g/mol
SMILES c1c(c(I)c(C(OCC)=O)cc1)OC(=O)OC(C)(C)C
SPLASH splash10-052g-4090000000-064073a8c3b9686ba4a9
Source of Spectrum A1-8-5673/SM3-3d
Wiley ID 1760971