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4-Hepten-3-one, 2,6-dichloro-5-methyl-, (E)-
SpectraBase Compound ID 8EPS4lTlQwZ
InChI InChI=1S/C8H12Cl2O/c1-5(6(2)9)4-8(11)7(3)10/h4,6-7H,1-3H3/b5-4-
InChIKey PEPAHLPVQGTDLE-PLNGDYQASA-N
Mol Weight 195.09 g/mol
Molecular Formula C8H12Cl2O
Exact Mass 194.02652 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjhkdW52Xfz
Name 4-Hepten-3-one, 2,6-dichloro-5-methyl-, (E)-
CAS Registry Number 76811-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12Cl2O
InChI InChI=1S/C8H12Cl2O/c1-5(6(2)9)4-8(11)7(3)10/h4,6-7H,1-3H3/b5-4-
InChIKey PEPAHLPVQGTDLE-PLNGDYQASA-N
Molecular Weight 195.089 g/mol
SMILES C(\C(=C/C(=O)C(Cl)C)C)(Cl)C
SPLASH splash10-0007-1900000000-94790472f128e431d65a
Source of Spectrum AN-89-564-0
Synonyms (4Z)-2,6-dichloro-5-methyl-4-hepten-3-one 2,6-Dichloro-5-methyl-4-heptene-3-one
Wiley ID 1190189