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(E)-5-(2-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-pent-4-enoic acid
SpectraBase Compound ID I6gFDZJsZGn
InChI InChI=1S/C14H11ClO3S2/c15-10-4-2-1-3-9(10)5-6-11(16)12(13(17)18)14-19-7-8-20-14/h1-6H,7-8H2,(H,17,18)/b6-5+
InChIKey DLOJHBHUXMVYFM-AATRIKPKSA-N
Mol Weight 326.81 g/mol
Molecular Formula C14H11ClO3S2
Exact Mass 325.983814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sTOouPzYhx
Name (E)-5-(2-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-keto-pent-4-enoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C14H11ClO3S2
InChI InChI=1S/C14H11ClO3S2/c15-10-4-2-1-3-9(10)5-6-11(16)12(13(17)18)14-19-7-8-20-14/h1-6H,7-8H2,(H,17,18)/b6-5+
InChIKey DLOJHBHUXMVYFM-AATRIKPKSA-N
Molecular Weight 326.812 g/mol
SMILES OC(C(=C1SCCS1)C(\C=C\c1c(Cl)cccc1)=O)=O
SPLASH splash10-004i-0039000000-42f082712cffb90d6c5e
Source of Spectrum SO-0-16-4
Synonyms (E)-5-(2-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxidanylidene-pent-4-enoic acid (E)-5-(2-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-4-pentenoic acid (E)-5-(2-chlorophenyl)-2-(1,3-dithiolan-2-ylidene)-3-oxo-pent-4-enoic acid
Wiley ID 1541946