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5-Chloro-2-(propylsulfanyl)-4(3H)-pyrimidinone
SpectraBase Compound ID 5HvC3LvjIHV
InChI InChI=1S/C7H9ClN2OS/c1-2-3-12-7-9-4-5(8)6(11)10-7/h4H,2-3H2,1H3,(H,9,10,11)
InChIKey DNFXIJSCZDZBFK-UHFFFAOYSA-N
Mol Weight 204.68 g/mol
Molecular Formula C7H9ClN2OS
Exact Mass 204.012412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7t2bTqeLAFC
Name 5-Chloro-2-(propylsulfanyl)-4(3H)-pyrimidinone
CAS Registry Number 106146-80-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9ClN2OS
InChI InChI=1S/C7H9ClN2OS/c1-2-3-12-7-9-4-5(8)6(11)10-7/h4H,2-3H2,1H3,(H,9,10,11)
InChIKey DNFXIJSCZDZBFK-UHFFFAOYSA-N
Molecular Weight 204.675 g/mol
SMILES N1C(=NC=C(C1=O)Cl)SCCC
SPLASH splash10-0w29-1910000000-57a9daf99249a42646c0
Source of Spectrum O-21-274-3
Synonyms 2-Propylthio-5-chloro-pyrimidin-4(3H)-one 5-Chloranyl-2-propylsulfanyl-1H-pyrimidin-6-one 5-Chloro-2-(propylthio)-1H-pyrimidin-6-one 5-Chloro-2-propylsulfanyl-1H-pyrimidin-6-one
Wiley ID 1201214