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1H-imidazole-1-acetic acid, 2,3-dihydro-3-methyl-2-thioxo-, methyl ester
SpectraBase Compound ID 44CFvXn5OKx
InChI InChI=1S/C7H10N2O2S/c1-8-3-4-9(7(8)12)5-6(10)11-2/h3-4H,5H2,1-2H3
InChIKey VKQADJUJIPRMSH-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 CEnMcGnkArs
Name 1H-imidazole-1-acetic acid, 2,3-dihydro-3-methyl-2-thioxo-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10N2O2S
InChI InChI=1S/C7H10N2O2S/c1-8-3-4-9(7(8)12)5-6(10)11-2/h3-4H,5H2,1-2H3
InChIKey VKQADJUJIPRMSH-UHFFFAOYSA-N
Molecular Weight 186.229 g/mol
SMILES C(OC)(=O)CN1C(N(C=C1)C)=S
SPLASH splash10-002u-9600000000-21a7e92ddca491a5a24a
Source of Spectrum JX-2015-5-46
Synonyms Methyl 2-(3-methyl-2-thioxo-2,3-dihydro-1H-imidazol-1-yl)acetate Methyl (3-methyl-2-thioxo-2,3-dihydro-1H-imidazol-1-yl)acetate 2-(3-Methyl-2-sulfanylidene-1-imidazolyl)acetic acid methyl ester Methyl 2-(3-methyl-2-sulfanylideneimidazol-1-yl)acetate Methyl 2-(3-methyl-2-thioxo-imidazol-1-yl)acetate Methyl 2-(3-methyl-2-sulfanylidene-imidazol-1-yl)ethanoate
Wiley ID 1726917