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3-Methyl-2-(methylthio)-4-imidazolecarboxylic acid methyl ester
SpectraBase Compound ID 1widjhvDFK
InChI InChI=1S/C7H10N2O2S/c1-9-5(6(10)11-2)4-8-7(9)12-3/h4H,1-3H3
InChIKey VPIQKJUJYBSVQC-UHFFFAOYSA-N
Mol Weight 186.23 g/mol
Molecular Formula C7H10N2O2S
Exact Mass 186.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbEpGUiexIZ
Name 3-Methyl-2-(methylthio)-4-imidazolecarboxylic acid methyl ester
Alternate Name(s) 3-Methyl-2-(methylthio)imidazole-4-carboxylic acid methyl ester Methyl 3-methyl-2-methylsulfanyl-imidazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10N2O2S
InChI InChI=1S/C7H10N2O2S/c1-9-5(6(10)11-2)4-8-7(9)12-3/h4H,1-3H3
InChIKey VPIQKJUJYBSVQC-UHFFFAOYSA-N
Molecular Weight 186.229 g/mol
SMILES c1([n](c(SC)nc1)C)C(=O)OC
SPLASH splash10-0f79-0900000000-c8269a032472d516152e
Source of Spectrum F-56-653-27
Wiley ID 855631