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7-Iodo-1-phenyl-2-heptyn-1-one
SpectraBase Compound ID FubUFLg2SJ8
InChI InChI=1S/C13H13IO/c14-11-7-2-1-6-10-13(15)12-8-4-3-5-9-12/h3-5,8-9H,1-2,7,11H2
InChIKey GZAMYQXYXDAKCL-UHFFFAOYSA-N
Mol Weight 312.15 g/mol
Molecular Formula C13H13IO
Exact Mass 312.00111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HM08J6j4TpQ
Name 7-Iodo-1-phenyl-2-heptyn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13IO
InChI InChI=1S/C13H13IO/c14-11-7-2-1-6-10-13(15)12-8-4-3-5-9-12/h3-5,8-9H,1-2,7,11H2
InChIKey GZAMYQXYXDAKCL-UHFFFAOYSA-N
Molecular Weight 312.150 g/mol
SMILES C(#CCCCCI)C(=O)c1ccccc1
SPLASH splash10-0a6r-3900000000-80f3ddd55b02bd2ac67f
Source of Spectrum QE-2-1218-81
Synonyms 7-iodanyl-1-phenyl-hept-2-yn-1-one 7-iodo-1-phenyl-hept-2-yn-1-one
Wiley ID 842873