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4-(4-Chlorophenyl)-2,3-dimethoxy-4-oxidanyl-cyclobut-2-en-1-one
SpectraBase Compound ID 73hUPpzODV7
InChI InChI=1S/C12H11ClO4/c1-16-9-10(14)12(15,11(9)17-2)7-3-5-8(13)6-4-7/h3-6,15H,1-2H3
InChIKey KXKCAXNQEUUVPQ-UHFFFAOYSA-N
Mol Weight 254.67 g/mol
Molecular Formula C12H11ClO4
Exact Mass 254.034587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vEFd5g5T3v
Name 4-(4-Chlorophenyl)-2,3-dimethoxy-4-oxidanyl-cyclobut-2-en-1-one
CAS Registry Number 112597-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClO4
InChI InChI=1S/C12H11ClO4/c1-16-9-10(14)12(15,11(9)17-2)7-3-5-8(13)6-4-7/h3-6,15H,1-2H3
InChIKey KXKCAXNQEUUVPQ-UHFFFAOYSA-N
Molecular Weight 254.669 g/mol
SMILES OC1(C(=C(C1=O)OC)OC)c1ccc(cc1)Cl
SPLASH splash10-02br-1930000000-d618818660ab8d2e98b6
Source of Spectrum J-53-1000-1
Synonyms 4-(4-Chlorophenyl)-4-hydroxy-2,3-dimethoxy-1-cyclobut-2-enone 4-(4-Chlorophenyl)-4-hydroxy-2,3-dimethoxy-2-cyclobuten-1-one 4-(4-Chlorophenyl)-4-hydroxy-2,3-dimethoxy-cyclobut-2-en-1-one
Wiley ID 1257344