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acetamide, 2-[[6-amino-3,5-dicyano-4-(4-methoxyphenyl)-2-pyridinyl]thio]-
SpectraBase Compound ID C5L4irkPFro
InChI InChI=1S/C16H13N5O2S/c1-23-10-4-2-9(3-5-10)14-11(6-17)15(20)21-16(12(14)7-18)24-8-13(19)22/h2-5H,8H2,1H3,(H2,19,22)(H2,20,21)
InChIKey JEPFCTSZZNZRPV-UHFFFAOYSA-N
Mol Weight 339.37 g/mol
Molecular Formula C16H13N5O2S
Exact Mass 339.078996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LOQ8RsP2w5j
Name acetamide, 2-[[6-amino-3,5-dicyano-4-(4-methoxyphenyl)-2-pyridinyl]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 339.078995851 u
Formula C16H13N5O2S
InChI InChI=1S/C16H13N5O2S/c1-23-10-4-2-9(3-5-10)14-11(6-17)15(20)21-16(12(14)7-18)24-8-13(19)22/h2-5H,8H2,1H3,(H2,19,22)(H2,20,21)
InChIKey JEPFCTSZZNZRPV-UHFFFAOYSA-N
Molecular Weight 339.373 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1603
Solvent DMSO-d6
Source Vendor ID: ZI/8157011; Lab Info: KR; Lab Number: KR-ug00159
Temperature 29.85 °C