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3-Methoxycarbonylmethyl-5-methyl-3H-imidazole-4-carboxylic acid methyl ester
SpectraBase Compound ID DNqVqQHSz4A
InChI InChI=1S/C9H12N2O4/c1-6-8(9(13)15-3)11(5-10-6)4-7(12)14-2/h5H,4H2,1-3H3
InChIKey NXESVDWUOYCFBH-UHFFFAOYSA-N
Mol Weight 212.2 g/mol
Molecular Formula C9H12N2O4
Exact Mass 212.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CYCNFtLm2wW
Name 3-Methoxycarbonylmethyl-5-methyl-3H-imidazole-4-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2O4
InChI InChI=1S/C9H12N2O4/c1-6-8(9(13)15-3)11(5-10-6)4-7(12)14-2/h5H,4H2,1-3H3
InChIKey NXESVDWUOYCFBH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol901051z
Molecular Weight 212.205 g/mol
SMILES COC(=O)c1c(nc[n]1CC(OC)=O)C
SPLASH splash10-0ue9-2910000000-57152e5c03adc207d912
Source of Spectrum A1-11-2840/SMS5-5i
Synonyms Methyl 1-(2-methoxy-2-oxoethyl)-4-methyl-1H-imidazole-5-carboxylate
Wiley ID 1756941