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4(1H)-pyrimidinone, 5-hexyl-2,3-dihydro-6-hydroxy-3-phenyl-2-thioxo-
SpectraBase Compound ID 1fUnYTMk4cR
InChI InChI=1S/C16H20N2O2S/c1-2-3-4-8-11-13-14(19)17-16(21)18(15(13)20)12-9-6-5-7-10-12/h5-7,9-10,19H,2-4,8,11H2,1H3,(H,17,21)
InChIKey RGUVAUORIWPZGG-UHFFFAOYSA-N
Mol Weight 304.41 g/mol
Molecular Formula C16H20N2O2S
Exact Mass 304.124549 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1XGmCCqLass
Name 4(1H)-pyrimidinone, 5-hexyl-2,3-dihydro-6-hydroxy-3-phenyl-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.124549064 u
Formula C16H20N2O2S
InChI InChI=1S/C16H20N2O2S/c1-2-3-4-8-11-13-14(19)17-16(21)18(15(13)20)12-9-6-5-7-10-12/h5-7,9-10,19H,2-4,8,11H2,1H3,(H,17,21)
InChIKey RGUVAUORIWPZGG-UHFFFAOYSA-N
Molecular Weight 304.408 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12687
Solvent DMSO-d6
Source Vendor ID: ZI/10024909; Lab Info: PLU; Lab Number: FCI-427-0012