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N-[2-(Methylsulfanyl)phenyl]-2-(2-pyrimidinylsulfanyl)acetamide
SpectraBase Compound ID 2CJb9F8hRRm
InChI InChI=1S/C13H13N3OS2/c1-18-11-6-3-2-5-10(11)16-12(17)9-19-13-14-7-4-8-15-13/h2-8H,9H2,1H3,(H,16,17)
InChIKey HXKPKBVKXDTPEI-UHFFFAOYSA-N
Mol Weight 291.39 g/mol
Molecular Formula C13H13N3OS2
Exact Mass 291.050004 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DumTQPwrL0l
Name acetamide, N-[2-(methylthio)phenyl]-2-(2-pyrimidinylthio)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.050004398 u
Formula C13H13N3OS2
InChI InChI=1S/C13H13N3OS2/c1-18-11-6-3-2-5-10(11)16-12(17)9-19-13-14-7-4-8-15-13/h2-8H,9H2,1H3,(H,16,17)
InChIKey HXKPKBVKXDTPEI-UHFFFAOYSA-N
Molecular Weight 291.387 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5569
Solvent DMSO-d6
Source Vendor ID: NMR/9322167; Lab Info: PNA; Lab Number: PNA-NA00898
Temperature 29.85 °C