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Ethyl 4-Chloroacetylpyrrole-2-carboxylate
SpectraBase Compound ID 6fOPXaroI21
InChI InChI=1S/C9H10ClNO3/c1-2-14-9(13)7-3-6(5-11-7)8(12)4-10/h3,5,11H,2,4H2,1H3
InChIKey KNOGOWCHAGHYDV-UHFFFAOYSA-N
Mol Weight 215.64 g/mol
Molecular Formula C9H10ClNO3
Exact Mass 215.034921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uNjNNBmDxQ
Name Ethyl 4-Chloroacetylpyrrole-2-carboxylate
Alternate Name(s) ethyl 4-(chloroacetyl)-1H-pyrrole-2-carboxylate 4-(2-chloro-1-oxoethyl)-1H-pyrrole-2-carboxylic acid ethyl ester ethyl 4-(2-chloroacetyl)-1H-pyrrole-2-carboxylate ethyl 4-(2-chloranylethanoyl)-1H-pyrrole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C9H10ClNO3
InChI InChI=1S/C9H10ClNO3/c1-2-14-9(13)7-3-6(5-11-7)8(12)4-10/h3,5,11H,2,4H2,1H3
InChIKey KNOGOWCHAGHYDV-UHFFFAOYSA-N
Molecular Weight 215.636 g/mol
SMILES [nH]1cc(cc1C(=O)OCC)C(=O)CCl
SPLASH splash10-00di-0910000000-ace0054d7096b4aaf6f8
Source of Spectrum E1-44-52-5
Wiley ID 1553250