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ZPZMHEVQAYDZBJ-UHFFFAOYSA-N
SpectraBase Compound ID 8ZrQCnDmPY9
InChI InChI=1S/C11H9BrN2S/c1-15-11-13-7-9(12)10(14-11)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey ZPZMHEVQAYDZBJ-UHFFFAOYSA-N
Mol Weight 281.17 g/mol
Molecular Formula C11H9BrN2S
Exact Mass 279.966982 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6W1bKsvulCs
Name 5-Bromanyl-2-methylsulfanyl-4-phenyl-pyrimidine
CAS Registry Number 123061-61-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9BrN2S
InChI InChI=1S/C11H9BrN2S/c1-15-11-13-7-9(12)10(14-11)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey ZPZMHEVQAYDZBJ-UHFFFAOYSA-N
Molecular Weight 281.171 g/mol
SMILES c1(nc(ncc1Br)SC)-c1ccccc1
SPLASH splash10-001i-0290000000-5506426cd9a52786d632
Source of Spectrum F-45-1002-17
Synonyms 5-Bromo-2-(methylthio)-4-phenyl-pyrimidine 5-Bromo-2-(methylthio)-4-phenylpyrimidine 5-Bromo-2-methylsulfanyl-4-phenylpyrimidine
Wiley ID 1283375