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[(6-purinyl)thio]acetic acid, ethyl ester

View entire compound with spectra: 3 NMR, 1 FTIR, and 2 UV-Vis

[(6-purinyl)thio]acetic acid, ethyl ester
SpectraBase Compound ID HzmqMknns3
InChI InChI=1S/C9H10N4O2S/c1-2-15-6(14)3-16-9-7-8(11-4-10-7)12-5-13-9/h4-5H,2-3H2,1H3,(H,10,11,12,13)
InChIKey RUTWSJRQLPNXEK-UHFFFAOYSA-N
Mol Weight 238.26 g/mol
Molecular Formula C9H10N4O2S
Exact Mass 238.052447 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2dlNJQ9ZU1c
Name (PURIN-6-YLTHIO)ACETIC ACID, ETHYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N4O2S
InChI InChI=1S/C9H10N4O2S/c1-2-15-6(14)3-16-9-7-8(11-4-10-7)12-5-13-9/h4-5H,2-3H2,1H3,(H,10,11,12,13)
InChIKey RUTWSJRQLPNXEK-UHFFFAOYSA-N
Molecular Weight 238.27
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, /PURIN-6-YLTHIO/-, ETHYL ESTER