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4-(2-iodo-3-keto-3-methoxy-propyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID 16U3tKec4Mx
InChI InChI=1S/C12H16INO4/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 FJWYRMNXWHGNPW-UHFFFAOYSA-N
Mol Weight 365.17 g/mol
Molecular Formula C12H16INO4
Exact Mass 365.012403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6wBngrmXLmP
Name 4-(2-iodo-3-keto-3-methoxy-propyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16INO4
InChI InChI=1S/C12H16INO4/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 FJWYRMNXWHGNPW-UHFFFAOYSA-N
Molecular Weight 365.167 g/mol
SMILES [nH]1c(c(c(c1C(=O)OC)C)CC(C(=O)OC)I)C
SPLASH splash10-00m0-0796000000-10dc4409d538522cedd0
Source of Spectrum D1-1997-1278-4
Synonyms 4-(2-iodo-3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid methyl ester Methyl 4-(2-iodanyl-3-methoxy-3-oxidanylidene-propyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Methyl 4-(2-iodo-3-methoxy-3-oxo-propyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 834984