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7,8,9,10-Tetrachloro-4,5-azepinobenzodioxoin-N-carboxylic acid ethyl ester
SpectraBase Compound ID 2RaPetNgZOz
InChI InChI=1S/C15H11Cl4NO4/c1-2-22-15(21)20-5-3-7-8(4-6-20)24-14-12(19)10(17)9(16)11(18)13(14)23-7/h3-8H,2H2,1H3
InChIKey YYQIOHXYUFPSNA-UHFFFAOYSA-N
Mol Weight 411.1 g/mol
Molecular Formula C15H11Cl4NO4
Exact Mass 408.944219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBwJ6aSl7FU
Name 7,8,9,10-Tetrachloro-4,5-azepinobenzodioxoin-N-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11Cl4NO4
InChI InChI=1S/C15H11Cl4NO4/c1-2-22-15(21)20-5-3-7-8(4-6-20)24-14-12(19)10(17)9(16)11(18)13(14)23-7/h3-8H,2H2,1H3
InChIKey YYQIOHXYUFPSNA-UHFFFAOYSA-N
Molecular Weight 411.068 g/mol
SMILES c12c(c(Cl)c(c(c2Cl)Cl)Cl)OC2C(O1)C=CN(C(=O)OCC)C=C2
SPLASH splash10-0f89-6900000000-5354a26349b2d5b5e5f7
Source of Spectrum O1-59-273-5
Wiley ID 1591931