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acetamide, N-(2-cyanophenyl)-2-[(4-hydroxy-6-propyl-2-pyrimidinyl)thio]-
SpectraBase Compound ID H6aaKAKzUBH
InChI InChI=1S/C16H16N4O2S/c1-2-5-12-8-14(21)20-16(18-12)23-10-15(22)19-13-7-4-3-6-11(13)9-17/h3-4,6-8H,2,5,10H2,1H3,(H,19,22)(H,18,20,21)
InChIKey HKZVCWOOYZCWNP-UHFFFAOYSA-N
Mol Weight 328.39 g/mol
Molecular Formula C16H16N4O2S
Exact Mass 328.099397 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2SZxzi9hxuM
Name acetamide, N-(2-cyanophenyl)-2-[(4-hydroxy-6-propyl-2-pyrimidinyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.099396943 u
Formula C16H16N4O2S
InChI InChI=1S/C16H16N4O2S/c1-2-5-12-8-14(21)20-16(18-12)23-10-15(22)19-13-7-4-3-6-11(13)9-17/h3-4,6-8H,2,5,10H2,1H3,(H,19,22)(H,18,20,21)
InChIKey HKZVCWOOYZCWNP-UHFFFAOYSA-N
Molecular Weight 328.390 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6652
Solvent DMSO-d6
Source Vendor ID: NMR/10220195; Lab Info: KTS; Lab Number: KTS-0000757
Temperature 23.85 °C