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3-Chloranyl-4-(2,5-dimethylphenyl)-2-oxidanyl-cyclobut-2-en-1-one
SpectraBase Compound ID JZd9RJj8C7t
InChI InChI=1S/C12H11ClO2/c1-6-3-4-7(2)8(5-6)9-10(13)12(15)11(9)14/h3-5,9,15H,1-2H3
InChIKey WUNJOWLQFOLRJS-UHFFFAOYSA-N
Mol Weight 222.67 g/mol
Molecular Formula C12H11ClO2
Exact Mass 222.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADWHktbc7c2
Name 3-Chloranyl-4-(2,5-dimethylphenyl)-2-oxidanyl-cyclobut-2-en-1-one
Alternate Name(s) 3-Chloro-4-(2,5-dimethylphenyl)-2-hydroxy-1-cyclobut-2-enone 3-Chloro-4-(2,5-dimethylphenyl)-2-hydroxy-cyclobut-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClO2
InChI InChI=1S/C12H11ClO2/c1-6-3-4-7(2)8(5-6)9-10(13)12(15)11(9)14/h3-5,9,15H,1-2H3
InChIKey WUNJOWLQFOLRJS-UHFFFAOYSA-N
Molecular Weight 222.671 g/mol
SMILES OC=1C(C(C1Cl)c1c(ccc(c1)C)C)=O
SPLASH splash10-0avi-0980000000-0357e2a532e191a40906
Source of Spectrum J-61-2090-8
Wiley ID 1222110