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Methyl (E)-4-iodobut-2-enoate
SpectraBase Compound ID DOSFUkvV4a
InChI InChI=1S/C5H7IO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3/b3-2+
InChIKey CQXZCMOTWVQDLY-NSCUHMNNSA-N
Mol Weight 226.01 g/mol
Molecular Formula C5H7IO2
Exact Mass 225.949074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSvmLL3i3on
Name Methyl (E)-4-iodobut-2-enoate
Appearance Colourless oil
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H7IO2
GC Oven Program Oven temp 320 oC, Splitless injector
InChI InChI=1S/C5H7IO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3/b3-2+
InChIKey CQXZCMOTWVQDLY-NSCUHMNNSA-N
Instrument Name Agilent Technologies 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/anie.201905814
Molecular Weight 226.013 g/mol
SMILES COC(\C=C\CI)=O
SPLASH splash10-0002-9300000000-37e2a117d83f3ae3d8b2
Source of Spectrum ACI-58-SM26-52
Wiley ID 1875441