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4-AMINO-2-MERCAPTO-5-PYRIMIDINECARBOXYLIC ACID, ETHYL ESTER

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4-AMINO-2-MERCAPTO-5-PYRIMIDINECARBOXYLIC ACID, ETHYL ESTER
SpectraBase Compound ID LNNfHkk495H
InChI InChI=1S/C7H9N3O2S/c1-2-12-6(11)4-3-9-7(13)10-5(4)8/h3H,2H2,1H3,(H3,8,9,10,13)
InChIKey DKTWKRWWQKVQQB-UHFFFAOYSA-N
Mol Weight 199.23 g/mol
Molecular Formula C7H9N3O2S
Exact Mass 199.041548 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID E1JnMdET2Ac
Name 4-AMINO-2-MERCAPTO-5-PYRIMIDINECARBOXYLIC ACID, ETHYL ESTER
Source of Sample C. Whitehead, the Lilly Research Laboratories, Indianapolis, Indiana
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N3O2S
InChI InChI=1S/C7H9N3O2S/c1-2-12-6(11)4-3-9-7(13)10-5(4)8/h3H,2H2,1H3,(H3,8,9,10,13)
InChIKey DKTWKRWWQKVQQB-UHFFFAOYSA-N
Molecular Weight 199.227997
Synonyms 5-PYRIMIDINECARBOXYLIC ACID, 4-AMINO- 2-MERCAPTO-, ETHYL ESTER
Technique KBr WAFER