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2,6-dioxo-5-[(phenylthio)methyl]-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid, methyl ester
SpectraBase Compound ID HWWVauOXo7E
InChI InChI=1S/C13H12N2O4S/c1-19-12(17)10-9(11(16)15-13(18)14-10)7-20-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,14,15,16,18)
InChIKey NWXAFVVVBZEMIE-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID D8gCnkQ3Ed
Name 2,6-DIOXO-5-[(PHENYLTHIO)METHYL]-1,2,3,6-TETRAHYDRO-4-PYRIMIDINECARBOXYLIC ACID, METHYL ESTER
Source of Sample J. Okada, Kyoto University, Kyoto, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c1-19-12(17)10-9(11(16)15-13(18)14-10)7-20-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,14,15,16,18)
InChIKey NWXAFVVVBZEMIE-UHFFFAOYSA-N
Literature Reference CHEM. PHARM. BULL. TOKYO 29, 667(1981) Abstract-Chemical Abstracts= 95, 43028(1981)
Melting Point 214.5-216.5C
Molecular Weight 292.308990
Synonyms 4-PYRIMIDINECARBOXYLIC ACID, 2,6-DI- OXO-5-//PHENYLTHIO/METHYL/-1,2,3,6- TETRAHYDRO-, METHYL ESTER
Technique KBr WAFER