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4-TERT.-BUTYL-3-METHYL-5-IODO-1H-PYRROLE-2-CARBOXYLATE

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4-TERT.-BUTYL-3-METHYL-5-IODO-1H-PYRROLE-2-CARBOXYLATE
SpectraBase Compound ID 4NzQlTTPAip
InChI InChI=1S/C12H18INO2/c1-6-16-11(15)9-7(2)8(10(13)14-9)12(3,4)5/h14H,6H2,1-5H3
InChIKey XPOZDZRTLGGUAG-UHFFFAOYSA-N
Mol Weight 335.19 g/mol
Molecular Formula C12H18INO2
Exact Mass 335.038224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5W6wDHyrhQS
Name 4-tert-Butyl-5-iodo-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 4-tert-butyl-5-iodanyl-3-methyl-1H-pyrrole-2-carboxylate Ethyl 4-tert-butyl-5-iodo-3-methyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18INO2
InChI InChI=1S/C12H18INO2/c1-6-16-11(15)9-7(2)8(10(13)14-9)12(3,4)5/h14H,6H2,1-5H3
InChIKey XPOZDZRTLGGUAG-UHFFFAOYSA-N
Molecular Weight 335.185 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)C)C(C)(C)C)I
SPLASH splash10-00di-0079000000-28b45aa08ddc291a1ee3
Source of Spectrum AH-134-895-4
Wiley ID 1546930