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[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]thiocarbamic acid, O-ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 UV-Vis

[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]thiocarbamic acid, O-ethyl ester
SpectraBase Compound ID 5xWKbVIVWeF
InChI InChI=1S/C9H14N4O3S/c1-3-16-9(17)10-4-5-12-7(2)11-6-8(12)13(14)15/h6H,3-5H2,1-2H3,(H,10,17)
InChIKey YEBWQGZCMKFRQS-UHFFFAOYSA-N
Mol Weight 258.3 g/mol
Molecular Formula C9H14N4O3S
Exact Mass 258.078661 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IjKRT7rqZr9
Name [2-(2-METHYL-5-NITROIMIDAZOL-1-YL)ETHYL]THIOCARBAMIC ACID, O-ETHYL ESTER
Source of Sample J. VAN ROMPAY, JANSSEN-PHARMACEUTICA N.V., BEERSE, BELGIUM
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N4O3S
InChI InChI=1S/C9H14N4O3S/c1-3-16-9(17)10-4-5-12-7(2)11-6-8(12)13(14)15/h6H,3-5H2,1-2H3,(H,10,17)
InChIKey YEBWQGZCMKFRQS-UHFFFAOYSA-N
Literature Reference EUR. J. MED. CHEM.-CHIM. THER. 11, 237(1976) Abstract-Chemical Abstracts= 86, 5370(1977)
Melting Point 169.2C
Molecular Weight 258.295990
Synonyms CARBAMIC ACID, /2-/2-METHYL- 5-NITROIMIDAZOL-1-YL/ETHYL/THIO-, O-ETHYL ESTER
Technique KBr WAFER