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(E)-ethyl 2-(hydroxy(p-tolyl)methyl)-3-iodoacrylate
SpectraBase Compound ID 3GRzra5xk2h
InChI InChI=1S/C13H15IO3/c1-3-17-13(16)11(8-14)12(15)10-6-4-9(2)5-7-10/h4-8,12,15H,3H2,1-2H3/b11-8+
InChIKey GCBXDUCUDPLVKK-DHZHZOJOSA-N
Mol Weight 346.16 g/mol
Molecular Formula C13H15IO3
Exact Mass 346.006589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57BhiCffUs2
Name (E)-ethyl 2-(hydroxy(p-tolyl)methyl)-3-iodoacrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15IO3
InChI InChI=1S/C13H15IO3/c1-3-17-13(16)11(8-14)12(15)10-6-4-9(2)5-7-10/h4-8,12,15H,3H2,1-2H3/b11-8+
InChIKey GCBXDUCUDPLVKK-DHZHZOJOSA-N
Literature Reference DOI 10.1021/ol702134w
Molecular Weight 346.164 g/mol
SMILES OC(c1ccc(cc1)C)\C(=C/I)C(OCC)=O
SPLASH splash10-0fk9-0960000000-a2ce4ab2408a97ec5d3d
Source of Spectrum A1-9-5087/SMS2-3c
Synonyms (E)-2-[hydroxy-(4-methylphenyl)methyl]-3-iodo-2-propenoic acid ethyl ester Ethyl (E)-2-[hydroxy-(4-methylphenyl)methyl]-3-iodoprop-2-enoate Ethyl (E)-2-[hydroxy(p-tolyl)methyl]-3-iodo-prop-2-enoate Ethyl (E)-3-iodanyl-2-[(4-methylphenyl)-oxidanyl-methyl]prop-2-enoate
Wiley ID 1758727