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5-Chloro-4-(propylsulfanyl)-2(1H)-pyrimidinone
SpectraBase Compound ID FySs1TIY8ex
InChI InChI=1S/C7H9ClN2OS/c1-2-3-12-6-5(8)4-9-7(11)10-6/h4H,2-3H2,1H3,(H,9,10,11)
InChIKey JOYQZRHYIOOBGV-UHFFFAOYSA-N
Mol Weight 204.67 g/mol
Molecular Formula C7H9ClN2OS
Exact Mass 204.012412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J6wqhhrdun
Name 5-Chloro-4-(propylsulfanyl)-2(1H)-pyrimidinone
CAS Registry Number 106146-85-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9ClN2OS
InChI InChI=1S/C7H9ClN2OS/c1-2-3-12-6-5(8)4-9-7(11)10-6/h4H,2-3H2,1H3,(H,9,10,11)
InChIKey JOYQZRHYIOOBGV-UHFFFAOYSA-N
Molecular Weight 204.675 g/mol
SMILES N1C(N=CC(=C1SCCC)Cl)=O
SPLASH splash10-03fr-0910000000-89e0546000f32e04b479
Source of Spectrum O-21-275-11
Synonyms 4-Propylthio-5-chloro-pyrimidin-2(1H)-one 5-Chloranyl-6-propylsulfanyl-1H-pyrimidin-2-one 5-Chloro-6-(propylthio)-1H-pyrimidin-2-one 5-Chloro-6-propylsulfanyl-1H-pyrimidin-2-one
Wiley ID 1201215