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(E)-1-Iodo-4-(4-acetoxy-3-methoxyphenyl)but-3-en-2-one
SpectraBase Compound ID INc7h5VdV1s
InChI InChI=1S/C13H13IO4/c1-9(15)18-12-6-4-10(7-13(12)17-2)3-5-11(16)8-14/h3-7H,8H2,1-2H3/b5-3+
InChIKey GHHHSLBQCUBXKC-HWKANZROSA-N
Mol Weight 360.15 g/mol
Molecular Formula C13H13IO4
Exact Mass 359.985854 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IZ2m45rDuz
Name (E)-1-Iodo-4-(4-acetoxy-3-methoxyphenyl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13IO4
InChI InChI=1S/C13H13IO4/c1-9(15)18-12-6-4-10(7-13(12)17-2)3-5-11(16)8-14/h3-7H,8H2,1-2H3/b5-3+
InChIKey GHHHSLBQCUBXKC-HWKANZROSA-N
Molecular Weight 360.147 g/mol
SMILES c1(OC(=O)C)c(cc(\C=C\C(=O)CI)cc1)OC
SPLASH splash10-0693-0902000000-04e8c78c4d614d4d784d
Source of Spectrum F4-40-3680-10n
Wiley ID 1671341