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Acetic acid, 2-(2-amino-5-chloro-6-methyl-4-pyrimidylthio)-, ethyl ester

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

Acetic acid, 2-(2-amino-5-chloro-6-methyl-4-pyrimidylthio)-, ethyl ester
SpectraBase Compound ID 2gB4Nq2w9IZ
InChI InChI=1S/C9H12ClN3O2S/c1-3-15-6(14)4-16-8-7(10)5(2)12-9(11)13-8/h3-4H2,1-2H3,(H2,11,12,13)
InChIKey ZMZXXPDLOGZBHO-UHFFFAOYSA-N
Mol Weight 261.73 g/mol
Molecular Formula C9H12ClN3O2S
Exact Mass 261.033876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1COnY3yprb
Name acetic acid, [(2-amino-5-chloro-6-methyl-4-pyrimidinyl)thio]-, ethylester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.033875510 u
Formula C9H12ClN3O2S
InChI InChI=1S/C9H12ClN3O2S/c1-3-15-6(14)4-16-8-7(10)5(2)12-9(11)13-8/h3-4H2,1-2H3,(H2,11,12,13)
InChIKey ZMZXXPDLOGZBHO-UHFFFAOYSA-N
Molecular Weight 261.727 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10865
Solvent DMSO-d6
Source Vendor ID: NMR/9216141; Lab Info: ART; Lab Number: ART-0005469