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Ethyl 2,5-dimethyl-4-(3',5'-dichlorophenyl)-1H-pyrrole-3-carboxylate
SpectraBase Compound ID IScBfUtlpvl
InChI InChI=1S/C15H15Cl2NO2/c1-4-20-15(19)14-9(3)18-8(2)13(14)10-5-11(16)7-12(17)6-10/h5-7,18H,4H2,1-3H3
InChIKey BUJHFNUEJUKWHL-UHFFFAOYSA-N
Mol Weight 312.2 g/mol
Molecular Formula C15H15Cl2NO2
Exact Mass 311.047984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hp5XU5MVERl
Name Ethyl 2,5-dimethyl-4-(3',5'-dichlorophenyl)-1H-pyrrole-3-carboxylate
Appearance Grey solid
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Exact Mass 311.047984125 u
Formula C15H15Cl2NO2
GC Oven Program Oven temp 300oC or 320oC
InChI InChI=1S/C15H15Cl2NO2/c1-4-20-15(19)14-9(3)18-8(2)13(14)10-5-11(16)7-12(17)6-10/h5-7,18H,4H2,1-3H3
InChIKey BUJHFNUEJUKWHL-UHFFFAOYSA-N
Inlet Type Split
Instrument Name Varian CP-3800-Saturn 2000 or Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810555
Reported Formula C15H15(35)Cl2NO2
SMILES N1C(=C(C(=C1C)C(=O)OCC)C1=CC(=CC(=C1)Cl)Cl)C
SPLASH splash10-01q9-0096000000-88e8e9fea36df8326a1f
Source of Spectrum ACI-57-SM13-12a (DOI: 10.1002/anie.201810555)
Wiley ID 1893653