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5-Bromo-4-(ethylsulfanyl)-2(1H)-pyrimidinone
SpectraBase Compound ID 4wSTyo0zZ30
InChI InChI=1S/C6H7BrN2OS/c1-2-11-5-4(7)3-8-6(10)9-5/h3H,2H2,1H3,(H,8,9,10)
InChIKey HBJVJAUVUFCQMO-UHFFFAOYSA-N
Mol Weight 235.1 g/mol
Molecular Formula C6H7BrN2OS
Exact Mass 233.946247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2W20YARVyI
Name 5-Bromo-4-(ethylsulfanyl)-2(1H)-pyrimidinone
Alternate Name(s) 4-Ethylthio-5-bromo-pyrimidin-2(1H)-one 5-Bromanyl-6-ethylsulfanyl-1H-pyrimidin-2-one 5-Bromo-6-(ethylthio)-1H-pyrimidin-2-one 5-Bromo-6-ethylsulfanyl-1H-pyrimidin-2-one
CAS Registry Number 106146-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7BrN2OS
InChI InChI=1S/C6H7BrN2OS/c1-2-11-5-4(7)3-8-6(10)9-5/h3H,2H2,1H3,(H,8,9,10)
InChIKey HBJVJAUVUFCQMO-UHFFFAOYSA-N
Molecular Weight 235.099 g/mol
SMILES N1C(N=CC(=C1SCC)Br)=O
SPLASH splash10-0a4i-0490000000-9e4779a8f7c30bc4d4fa
Source of Spectrum O-21-275-14
Wiley ID 1235279