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3-Chloro-4-phenylacetylcyclobut-3-en-1,2-dione
SpectraBase Compound ID FK1DNpgYrCy
InChI InChI=1S/C12H7ClO3/c13-10-9(11(15)12(10)16)8(14)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey YKVSTLNMZJOART-UHFFFAOYSA-N
Mol Weight 234.64 g/mol
Molecular Formula C12H7ClO3
Exact Mass 234.008372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lRbrMCMnIV
Name 3-Chloro-4-phenylacetylcyclobut-3-en-1,2-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7ClO3
InChI InChI=1S/C12H7ClO3/c13-10-9(11(15)12(10)16)8(14)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey YKVSTLNMZJOART-UHFFFAOYSA-N
Molecular Weight 234.638 g/mol
SMILES C1(=C(Cl)C(C1=O)=O)C(Cc1ccccc1)=O
SPLASH splash10-0006-9000000000-b8b53b0a1d4ef50994df
Source of Spectrum KC-1993-267-8
Synonyms 3-Chloro-4-(phenylacetyl)-3-cyclobutene-1,2-dione 3-Chloro-4-phenacyclobut-3-en-1,2-dione
Wiley ID 778826