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Methyl 2,4-dimethyl-3-[2'-(methoxycarbonyl)-2'-chloroethyl]pyrrole-5-carboxylate
SpectraBase Compound ID IndpzgwXqPA
InChI InChI=1S/C12H16ClNO4/c1-6-8(5-9(13)11(15)17-3)7(2)14-10(6)12(16)18-4/h9,14H,5H2,1-4H3
InChIKey JZKNVAGFISGPRS-UHFFFAOYSA-N
Mol Weight 273.72 g/mol
Molecular Formula C12H16ClNO4
Exact Mass 273.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMSvhllrxJU
Name Methyl 2,4-dimethyl-3-[2'-(methoxycarbonyl)-2'-chloroethyl]pyrrole-5-carboxylate
Alternate Name(s) Methyl 2-Chloro-3-(2,4-dimethyl-5-methoxycarbonyl-1H-pyrrol-3-yl)propanoate Methyl 2,4-dimethyl-3-[2'-(methoxycarbonyl)-1'-chloroethyl]pyrrole-5-carboxylate Methyl 4-(2-chloro-3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
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Formula C12H16ClNO4
InChI InChI=1S/C12H16ClNO4/c1-6-8(5-9(13)11(15)17-3)7(2)14-10(6)12(16)18-4/h9,14H,5H2,1-4H3
InChIKey JZKNVAGFISGPRS-UHFFFAOYSA-N
Molecular Weight 273.716 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC)C)CC(C(=O)OC)Cl)C
SPLASH splash10-00lr-0920000000-dcd22b104ef0c99f905d
Source of Spectrum J-63-6227-11
Wiley ID 1277024