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5-Chloro-4-(2-methoxycarbonyl-ethyl)-3-methoxycarbonylmethyl-1H-pyrrole-2-carboxylic acid, methyl ester
SpectraBase Compound ID Jrl7D1D7kso
InChI InChI=1S/C13H16ClNO6/c1-19-9(16)5-4-7-8(6-10(17)20-2)11(13(18)21-3)15-12(7)14/h15H,4-6H2,1-3H3
InChIKey CRMDGBAFJWLZTN-UHFFFAOYSA-N
Mol Weight 317.73 g/mol
Molecular Formula C13H16ClNO6
Exact Mass 317.066615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LTDV00ld2W
Name 5-Chloro-4-(2-methoxycarbonyl-ethyl)-3-methoxycarbonylmethyl-1H-pyrrole-2-carboxylic acid, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClNO6
InChI InChI=1S/C13H16ClNO6/c1-19-9(16)5-4-7-8(6-10(17)20-2)11(13(18)21-3)15-12(7)14/h15H,4-6H2,1-3H3
InChIKey CRMDGBAFJWLZTN-UHFFFAOYSA-N
Molecular Weight 317.725 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC)CC(=O)OC)CCC(=O)OC)Cl
SPLASH splash10-0670-7970000000-c665ea14c4ae9148f7d4
Synonyms 5-Chloro-3-(2-keto-2-methoxy-ethyl)-4-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid methyl ester 5-Chloro-3-(2-methoxy-2-oxoethyl)-4-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid methyl ester Methyl 5-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylate Methyl 5-chloro-3-(2-methoxy-2-oxo-ethyl)-4-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylate
Wiley ID 1484634