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2,5,5-trimethyl-1-oxido-4-(2-thienyl)pyrrol-1-ium-3-carboxylic acid ethyl ester
SpectraBase Compound ID IguGz2ZgyU2
InChI InChI=1S/C14H17NO3S/c1-5-18-13(16)11-9(2)15(17)14(3,4)12(11)10-7-6-8-19-10/h6-8H,5H2,1-4H3
InChIKey NTDYLDXKRXERGW-UHFFFAOYSA-N
Mol Weight 279.35 g/mol
Molecular Formula C14H17NO3S
Exact Mass 279.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55MWGyQ9wTo
Name 2,5,5-trimethyl-1-oxido-4-(2-thienyl)pyrrol-1-ium-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3S
InChI InChI=1S/C14H17NO3S/c1-5-18-13(16)11-9(2)15(17)14(3,4)12(11)10-7-6-8-19-10/h6-8H,5H2,1-4H3
InChIKey NTDYLDXKRXERGW-UHFFFAOYSA-N
Molecular Weight 279.354 g/mol
SMILES C1([N+](=C(C(=C1c1sccc1)C(=O)OCC)C)[O-])(C)C
SPLASH splash10-052g-9000000000-34939d7649cd96604d9f
Source of Spectrum SO-0-1499-3
Synonyms 2,5,5-trimethyl-1-oxido-4-thiophen-2-yl-3-pyrrol-1-iumcarboxylic acid ethyl ester Ethyl 2,5,5-trimethyl-1-oxidanidyl-4-thiophen-2-yl-pyrrol-1-ium-3-carboxylate Ethyl 2,5,5-trimethyl-1-oxido-4-(2-thienyl)pyrrol-1-ium-3-carboxylate Ethyl 2,5,5-trimethyl-1-oxido-4-thiophen-2-ylpyrrol-1-ium-3-carboxylate
Wiley ID 875950