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2-Chloro-4-hydroxy-3-methoxy-4-phenylacetylcyclobut-2-enone
SpectraBase Compound ID Gwnd5sXJF6h
InChI InChI=1S/C13H11ClO4/c1-18-12-10(14)11(16)13(12,17)9(15)7-8-5-3-2-4-6-8/h2-6,17H,7H2,1H3
InChIKey KPZXGRVJJFVBBY-UHFFFAOYSA-N
Mol Weight 266.68 g/mol
Molecular Formula C13H11ClO4
Exact Mass 266.034587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ZaIgHvdQ38
Name 2-Chloro-4-hydroxy-3-methoxy-4-phenylacetylcyclobut-2-enone
Comments Less than 3 mono-isotopic peaks
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Formula C13H11ClO4
InChI InChI=1S/C13H11ClO4/c1-18-12-10(14)11(16)13(12,17)9(15)7-8-5-3-2-4-6-8/h2-6,17H,7H2,1H3
InChIKey KPZXGRVJJFVBBY-UHFFFAOYSA-N
Molecular Weight 266.680 g/mol
SMILES OC1(C(OC)=C(C1=O)Cl)C(Cc1ccccc1)=O
SPLASH splash10-0a4i-0900000000-26cd6bfc2ec4ad359441
Source of Spectrum KC-1993-269-9
Synonyms 2-chloro-4-hydroxy-3-methoxy-4-(phenylacetyl)-2-cyclobuten-1-one 2-Chloro-4-hydroxy-3-methoxy-4-phenacyclobut-2-enone
Wiley ID 778808