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(E)-1,4,7-Trichloro-3-hepten-2-one
SpectraBase Compound ID FwLskZyyS7k
InChI InChI=1S/C7H9Cl3O/c8-3-1-2-6(10)4-7(11)5-9/h4H,1-3,5H2/b6-4+
InChIKey WZKIUOXUWOQPMB-GQCTYLIASA-N
Mol Weight 215.51 g/mol
Molecular Formula C7H9Cl3O
Exact Mass 213.971898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KV1AQqiGyvy
Name (E)-1,4,7-Trichloro-3-hepten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9Cl3O
InChI InChI=1S/C7H9Cl3O/c8-3-1-2-6(10)4-7(11)5-9/h4H,1-3,5H2/b6-4+
InChIKey WZKIUOXUWOQPMB-GQCTYLIASA-N
Literature Reference DOI 10.1021/ol802260w
Molecular Weight 215.507 g/mol
SMILES C(CCCl)\C(=C/C(CCl)=O)Cl
SPLASH splash10-014i-2900000000-12641563d545ad1a17b7
Source of Spectrum A1-10-5469/SMS7-(E)_3aD
Synonyms (E)-1,4,7-trichlorohept-3-en-2-one (E)-1,4,7-tris(chloranyl)hept-3-en-2-one
Wiley ID 1760049