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(E)-3-((tert-Butoxycarbonyl)(2-iodophenyl)amino)prop-1-en-1-yl acetate
SpectraBase Compound ID 1ysAnM13GKK
InChI InChI=1S/C16H20INO4/c1-12(19)21-11-7-10-18(15(20)22-16(2,3)4)14-9-6-5-8-13(14)17/h5-9,11H,10H2,1-4H3/b11-7+
InChIKey VJRUJCAOOCNPAU-YRNVUSSQSA-N
Mol Weight 417.24 g/mol
Molecular Formula C16H20INO4
Exact Mass 417.043703 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKhiAz2XYhr
Name (E)-3-((tert-Butoxycarbonyl)(2-iodophenyl)amino)prop-1-en-1-yl acetate
Appearance Colourless oil
Carrier Gas Helium
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Formula C16H20INO4
GC Oven Program Oven temp 320 oC, Splitless injector
InChI InChI=1S/C16H20INO4/c1-12(19)21-11-7-10-18(15(20)22-16(2,3)4)14-9-6-5-8-13(14)17/h5-9,11H,10H2,1-4H3/b11-7+
InChIKey VJRUJCAOOCNPAU-YRNVUSSQSA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201905814
Molecular Weight 417.243 g/mol
Reported Formula C16H20INO4
SMILES C(OC(C)(C)C)(N(c1c(cccc1)I)C\C=C\OC(C)=O)=O
SPLASH splash10-0a4i-9510000000-0852bd36d8041e041f1d
Source of Spectrum ACI-58-SM26-18b
Wiley ID 1875418