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(1E)-5-Chloro-2,3-dimethyl-2,5-cyclohexadiene-1,4-dione 1-(O-benzoyloxime)
SpectraBase Compound ID 3e1Bp7dbQK0
InChI InChI=1S/C15H12ClNO3/c1-9-10(2)14(18)12(16)8-13(9)17-20-15(19)11-6-4-3-5-7-11/h3-8H,1-2H3/b17-13+
InChIKey ALXXYZDHMQUFJR-GHRIWEEISA-N
Mol Weight 289.72 g/mol
Molecular Formula C15H12ClNO3
Exact Mass 289.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Yi4ciZX4tz
Name (1E)-5-Chloro-2,3-dimethyl-2,5-cyclohexadiene-1,4-dione 1-(O-benzoyloxime)
Alternate Name(s) 2,5-Cyclohexadiene-1,4-dione, 5-chloro-2,3-dimethyl-, 1-oxime, o-benzoyl- benzoic acid [(E)-(5-chloro-2,3-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)amino] ester [(E)-(5-chloro-2,3-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino] benzoate [(E)-(5-chloro-2,3-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] benzoate [(E)-(5-chloranyl-2,3-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] benzoate
CAS Registry Number 324051-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClNO3
InChI InChI=1S/C15H12ClNO3/c1-9-10(2)14(18)12(16)8-13(9)17-20-15(19)11-6-4-3-5-7-11/h3-8H,1-2H3/b17-13+
InChIKey ALXXYZDHMQUFJR-GHRIWEEISA-N
Molecular Weight 289.718 g/mol
SMILES C1(=C(\C(=N\OC(=O)c2ccccc2)C=C(C1=O)Cl)C)C
SPLASH splash10-0a4i-4900000000-8a216d76523bc84bdb62
Source of Spectrum AD-0-2532-0
Wiley ID 1426089