For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(1E)-5-Chloro-2,3-dimethyl-2,5-cyclohexadiene-1,4-dione 1-[O-(4-nitrobenzoyl)oxime]
SpectraBase Compound ID CgVQxWkCYG6
InChI InChI=1S/C15H11ClN2O5/c1-8-9(2)14(19)12(16)7-13(8)17-23-15(20)10-3-5-11(6-4-10)18(21)22/h3-7H,1-2H3/b17-13+
InChIKey LTZFYIWQAMZGIU-GHRIWEEISA-N
Mol Weight 334.72 g/mol
Molecular Formula C15H11ClN2O5
Exact Mass 334.035649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8xqmwJdehJM
Name (1E)-5-Chloro-2,3-dimethyl-2,5-cyclohexadiene-1,4-dione 1-[O-(4-nitrobenzoyl)oxime]
CAS Registry Number 324051-61-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11ClN2O5
InChI InChI=1S/C15H11ClN2O5/c1-8-9(2)14(19)12(16)7-13(8)17-23-15(20)10-3-5-11(6-4-10)18(21)22/h3-7H,1-2H3/b17-13+
InChIKey LTZFYIWQAMZGIU-GHRIWEEISA-N
Molecular Weight 334.715 g/mol
SMILES C1(=C(\C(=N\OC(c2ccc(N(=O)=O)cc2)=O)C=C(C1=O)Cl)C)C
SPLASH splash10-0udi-5900000000-a010434aff9c57332015
Source of Spectrum AD-0-2532-0
Synonyms 2,5-Cyclohexadiene-1,4-dione, 5-chloro-2,3-dimethyl-, 1-oxime, o-(4-nitrobenzoyl)- 4-Nitrobenzoic 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] 4-nitrobenzoate [(E)-(5-chloro-2,3-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate [(E)-(5-chloranyl-2,3-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)amino] 4-nitrobenzoate
Wiley ID 1426281