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Methyl (E)-5,8-dichloro-7-oxo-5-octenoate
SpectraBase Compound ID 6n9fdkpacoU
InChI InChI=1S/C9H12Cl2O3/c1-14-9(13)4-2-3-7(11)5-8(12)6-10/h5H,2-4,6H2,1H3/b7-5+
InChIKey CSTWOBKEPRZESF-FNORWQNLSA-N
Mol Weight 239.1 g/mol
Molecular Formula C9H12Cl2O3
Exact Mass 238.01635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8yU2Vk13CZ
Name Methyl (E)-5,8-dichloro-7-oxo-5-octenoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12Cl2O3
InChI InChI=1S/C9H12Cl2O3/c1-14-9(13)4-2-3-7(11)5-8(12)6-10/h5H,2-4,6H2,1H3/b7-5+
InChIKey CSTWOBKEPRZESF-FNORWQNLSA-N
Literature Reference DOI 10.1021/ol802260w
Molecular Weight 239.098 g/mol
SMILES C(\C(=C/C(CCl)=O)Cl)CCC(OC)=O
SPLASH splash10-00yi-4900000000-46547f0b86278a50acdc
Source of Spectrum A1-10-5469/SMS9-(E)_3aF
Synonyms (E)-methyl 5,8-dichloro-7-oxooct-5-enoate
Wiley ID 1760051