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3-[1-(5-Chloro-2-methyl-phenyl)-eth-(E)-ylidene]-dihydro-furan-2,5-dione
SpectraBase Compound ID KI9fInhmJFI
InChI InChI=1S/C13H11ClO3/c1-7-3-4-9(14)5-10(7)8(2)11-6-12(15)17-13(11)16/h3-5H,6H2,1-2H3/b11-8+
InChIKey MKUMARIFQGPEDE-DHZHZOJOSA-N
Mol Weight 250.68 g/mol
Molecular Formula C13H11ClO3
Exact Mass 250.039672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqGamHMdr3M
Name 3-[1-(5-Chloro-2-methyl-phenyl)-eth-(E)-ylidene]-dihydro-furan-2,5-dione
Alternate Name(s) (E)-3-Carboxy-4-methyl-4-(3'-chloro-6'-methylphenyl)but-3-enoic anhydride (3E)-3-[1-(5-chloro-2-methylphenyl)ethylidene]dihydro-2,5-furandione (E)-3-Carboxy-4-(3'-chloro-6'-methylphenyl)pent-3-enoic anhydride
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Formula C13H11ClO3
InChI InChI=1S/C13H11ClO3/c1-7-3-4-9(14)5-10(7)8(2)11-6-12(15)17-13(11)16/h3-5H,6H2,1-2H3/b11-8+
InChIKey MKUMARIFQGPEDE-DHZHZOJOSA-N
Molecular Weight 250.681 g/mol
SMILES C1(\C(CC(O1)=O)=C\(c1c(ccc(c1)Cl)C)C)=O
SPLASH splash10-0fb9-3920000000-9d5ad4e0d98ea1a185b2
Source of Spectrum F7-15-248-4
Wiley ID 1556808