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1-Benzoylamino-4-phenyl-2-methylthiopyrimidinium iodide
SpectraBase Compound ID JpviBBMt7FG
InChI InChI=1S/C18H15N3OS.HI/c1-23-18-19-16(14-8-4-2-5-9-14)12-13-21(18)20-17(22)15-10-6-3-7-11-15;/h2-13H,1H3;1H
InChIKey ZHUGUWMNYBLDQJ-UHFFFAOYSA-N
Mol Weight 449.31 g/mol
Molecular Formula C18H16IN3OS
Exact Mass 449.005878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GP5PECaX3fB
Name 1-Benzoylamino-4-phenyl-2-methylthiopyrimidinium iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16IN3OS
InChI InChI=1S/C18H15N3OS.HI/c1-23-18-19-16(14-8-4-2-5-9-14)12-13-21(18)20-17(22)15-10-6-3-7-11-15;/h2-13H,1H3;1H
InChIKey ZHUGUWMNYBLDQJ-UHFFFAOYSA-N
Molecular Weight 449.310 g/mol
SMILES [I-].N([n+]1c(nc(cc1)-c1ccccc1)SC)C(=O)c1ccccc1
SPLASH splash10-004i-3910000000-09a99b4f20b82a0707b1
Source of Spectrum AH-120-754-3
Synonyms 1-(benzoylamino)-2-(methylsulfanyl)-4-phenylpyrimidin-1-ium iodide
Wiley ID 1387390