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4-nitrobenzoic acid [(5,6-dichloro-4-keto-3,5-dimethyl-1-cyclohex-2-enylidene)amino] ester
SpectraBase Compound ID 7UIHoAJ9GzS
InChI InChI=1S/C15H12Cl2N2O5/c1-8-7-11(12(16)15(2,17)13(8)20)18-24-14(21)9-3-5-10(6-4-9)19(22)23/h3-7,12H,1-2H3/b18-11-
InChIKey MYMKPPMSKOOGIW-WQRHYEAKSA-N
Mol Weight 371.18 g/mol
Molecular Formula C15H12Cl2N2O5
Exact Mass 370.012327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IShT87Vj43V
Name (4Z)-5,6-Dichloro-2,6-dimethyl-2-cyclohexene-1,4-dione 4-[O-(4-nitrobenzoyl)oxime]
CAS Registry Number 324051-46-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12Cl2N2O5
InChI InChI=1S/C15H12Cl2N2O5/c1-8-7-11(12(16)15(2,17)13(8)20)18-24-14(21)9-3-5-10(6-4-9)19(22)23/h3-7,12H,1-2H3/b18-11-
InChIKey MYMKPPMSKOOGIW-WQRHYEAKSA-N
Molecular Weight 371.176 g/mol
SMILES C1(C(C(C)=C\C(C1Cl)=N\OC(c1ccc(N(=O)=O)cc1)=O)=O)(Cl)C
SPLASH splash10-0udi-4900000000-c201b72486702e2d0cf6
Source of Spectrum AD-0-2532-0
Synonyms 2-Cyclohexene-1,4-dione, 5,6-dichloro-3,5-dimethyl-, 1-oxime, o-(4-nitrobenzoyl)- 4-Nitrobenzoic acid [(Z)-(5,6-dichloro-3,5-dimethyl-4-oxo-1-cyclohex-2-enylidene)amino] ester [(Z)-(5,6-dichloro-3,5-dimethyl-4-oxocyclohex-2-en-1-ylidene)amino] 4-nitrobenzoate [(Z)-(5,6-dichloro-3,5-dimethyl-4-oxo-cyclohex-2-en-1-ylidene)amino] 4-nitrobenzoate [(Z)-[5,6-bis(chloranyl)-3,5-dimethyl-4-oxidanylidene-cyclohex-2-en-1-ylidene]amino] 4-nitrobenzoate
Wiley ID 1426241