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3-(2-Iodobenzyl)hex-5-en-2-one

View entire compound with spectra: 1 MS (GC)

3-(2-Iodobenzyl)hex-5-en-2-one
SpectraBase Compound ID X3XWghiOsA
InChI InChI=1S/C13H15IO/c1-3-6-11(10(2)15)9-12-7-4-5-8-13(12)14/h3-5,7-8,11H,1,6,9H2,2H3
InChIKey DKXVFYOQBBZCIM-UHFFFAOYSA-N
Mol Weight 314.17 g/mol
Molecular Formula C13H15IO
Exact Mass 314.01676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpEnTVWEVPk
Name 3-(2-Iodobenzyl)hex-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15IO
InChI InChI=1S/C13H15IO/c1-3-6-11(10(2)15)9-12-7-4-5-8-13(12)14/h3-5,7-8,11H,1,6,9H2,2H3
InChIKey DKXVFYOQBBZCIM-UHFFFAOYSA-N
Molecular Weight 314.166 g/mol
SMILES C(c1c(I)cccc1)C(C(=O)C)CC=C
SPLASH splash10-014s-0940000000-57c95175f13a3147f9e8
Source of Spectrum KC-0-1087-15
Synonyms 3-[(2-iodanylphenyl)methyl]hex-5-en-2-one 3-[(2-iodophenyl)methyl]-5-hexen-2-one 3-[(2-iodophenyl)methyl]hex-5-en-2-one
Wiley ID 785494