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4-Phenyl-6-(2,4-dichloro-5-fluorophenyl)-3,4-dihydropyrimidin-2(1H)-thione
SpectraBase Compound ID 1qGr4dgRPYb
InChI InChI=1S/C16H11Cl2FN2S/c17-11-7-12(18)13(19)6-10(11)15-8-14(20-16(22)21-15)9-4-2-1-3-5-9/h1-8,14H,(H2,20,21,22)
InChIKey CUILDZSBEFMDGM-UHFFFAOYSA-N
Mol Weight 353.24 g/mol
Molecular Formula C16H11Cl2FN2S
Exact Mass 352.000403 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHrlmFTQrj5
Name 4-Phenyl-6-(2,4-dichloro-5-fluorophenyl)-3,4-dihydropyrimidin-2(1H)-thione
Alternate Name(s) 6-(2,4-dichloro-5-fluorophenyl)-4-phenyl-3,4-dihydropyrimidine-2(1H)-thione 6-(2,4-dichloro-5-fluorophenyl)-4-phenyl-3,4-dihydro-1H-pyrimidine-2-thione 6-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11Cl2FN2S
InChI InChI=1S/C16H11Cl2FN2S/c17-11-7-12(18)13(19)6-10(11)15-8-14(20-16(22)21-15)9-4-2-1-3-5-9/h1-8,14H,(H2,20,21,22)
InChIKey CUILDZSBEFMDGM-UHFFFAOYSA-N
Molecular Weight 353.242 g/mol
SMILES N1C(=CC(NC1=S)c1ccccc1)c1c(cc(c(c1)F)Cl)Cl
SPLASH splash10-0udr-1319000000-da91c99cf89e287116fe
Source of Spectrum EMC-39-779-4a
Wiley ID 1734876