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4-imidazolidineacetamide, 5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-[3-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 9sgswFXsyXy
InChI InChI=1S/C18H15F3N4O2S/c19-18(20,21)12-4-1-5-13(7-12)25-16(27)14(8-15(22)26)24(17(25)28)10-11-3-2-6-23-9-11/h1-7,9,14H,8,10H2,(H2,22,26)
InChIKey SQAQUUMYECVCIH-UHFFFAOYSA-N
Mol Weight 408.4 g/mol
Molecular Formula C18H15F3N4O2S
Exact Mass 408.086781 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KK0qGbBU4Qo
Name 4-imidazolidineacetamide, 5-oxo-3-(3-pyridinylmethyl)-2-thioxo-1-[3-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.086781400 u
Formula C18H15F3N4O2S
InChI InChI=1S/C18H15F3N4O2S/c19-18(20,21)12-4-1-5-13(7-12)25-16(27)14(8-15(22)26)24(17(25)28)10-11-3-2-6-23-9-11/h1-7,9,14H,8,10H2,(H2,22,26)
InChIKey SQAQUUMYECVCIH-UHFFFAOYSA-N
Molecular Weight 408.399 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7308
Solvent DMSO-d6
Source Vendor ID: NMR/10222772; Lab Info: PE; Lab Number: PE-0790264