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4(1H)-Pyrimidinone, 5-bromo-2-(butylthio)-
SpectraBase Compound ID AcLFPcEL96W
InChI InChI=1S/C8H11BrN2OS/c1-2-3-4-13-8-10-5-6(9)7(12)11-8/h5H,2-4H2,1H3,(H,10,11,12)
InChIKey BZTWWTMHUGPPHL-UHFFFAOYSA-N
Mol Weight 263.15 g/mol
Molecular Formula C8H11BrN2OS
Exact Mass 261.977547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IziSPGwEAxM
Name 4(1H)-Pyrimidinone, 5-bromo-2-(butylthio)-
Alternate Name(s) 2-Butylthio-5-bromo-pyrimidin-4(3H)-one 2-n-butylthio-5-bromouracile 5-Bromo-2-(butylsulfanyl)-4(3H)-pyrimidinone
CAS Registry Number 106146-83-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11BrN2OS
InChI InChI=1S/C8H11BrN2OS/c1-2-3-4-13-8-10-5-6(9)7(12)11-8/h5H,2-4H2,1H3,(H,10,11,12)
InChIKey BZTWWTMHUGPPHL-UHFFFAOYSA-N
Molecular Weight 263.153 g/mol
SMILES N1C(=NC=C(C1=O)Br)SCCCC
SPLASH splash10-0avi-0590000000-6886c2ffe6a60d49a732
Source of Spectrum O-21-274-8
Wiley ID 1265175