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1,3-Benzenedicarboxylic acid, 5-[[(4-chloro-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino]-, dimethyl ester
SpectraBase Compound ID L4uiWwWxLMu
InChI InChI=1S/C16H16ClN3O5/c1-4-20-8-12(17)13(19-20)14(21)18-11-6-9(15(22)24-2)5-10(7-11)16(23)25-3/h5-8H,4H2,1-3H3,(H,18,21)
InChIKey JBPGUZHMWJNXBI-UHFFFAOYSA-N
Mol Weight 365.77 g/mol
Molecular Formula C16H16ClN3O5
Exact Mass 365.077848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrnaIFSWW2q
Name 1,3-Benzenedicarboxylic acid, 5-[[(4-chloro-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino]-, dimethyl ester
Alternate Name(s) 5-[[(4-chloro-1-ethyl-3-pyrazolyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-[(4-chloro-1-ethylpyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate Dimethyl 5-[(4-chloro-1-ethyl-pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate Dimethyl 5-[(4-chloranyl-1-ethyl-pyrazol-3-yl)carbonylamino]benzene-1,3-dicarboxylate
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Formula C16H16ClN3O5
InChI InChI=1S/C16H16ClN3O5/c1-4-20-8-12(17)13(19-20)14(21)18-11-6-9(15(22)24-2)5-10(7-11)16(23)25-3/h5-8H,4H2,1-3H3,(H,18,21)
InChIKey JBPGUZHMWJNXBI-UHFFFAOYSA-N
Molecular Weight 365.773 g/mol
SMILES N(c1cc(cc(C(=O)OC)c1)C(=O)OC)C(=O)c1n[n](cc1Cl)CC
SPLASH splash10-0a4i-2900000000-56057573226fa9e2d3ea
Source of Spectrum IY-1-4516-6
Wiley ID 1653149