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4-Chloro-2-cyano-2,5-dimethylcyclopent-4-ene-1,3-dione
SpectraBase Compound ID H2RGfEQBmKi
InChI InChI=1S/C8H6ClNO2/c1-4-5(9)7(12)8(2,3-10)6(4)11/h1-2H3
InChIKey DAJVFOLJBQYHFM-UHFFFAOYSA-N
Mol Weight 183.59 g/mol
Molecular Formula C8H6ClNO2
Exact Mass 183.008706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0S9JZ4ARFv
Name 4-Chloro-2-cyano-2,5-dimethylcyclopent-4-ene-1,3-dione
CAS Registry Number 74987-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClNO2
InChI InChI=1S/C8H6ClNO2/c1-4-5(9)7(12)8(2,3-10)6(4)11/h1-2H3
InChIKey DAJVFOLJBQYHFM-UHFFFAOYSA-N
Molecular Weight 183.594 g/mol
SMILES C1(C(C(C)=C(C1=O)Cl)=O)(C#N)C
SPLASH splash10-0fz9-7900000000-d8f7d521e65485fdd974
Source of Spectrum J-45-4489-0
Synonyms 3-Chloro-1,4-dimethyl-2,5-dioxo-3-cyclopentene-1-carbonitrile
Wiley ID 1179523