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7-methyl-2-(3-bromophenoxy)methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID 45II8s4rHY7
InChI InChI=1S/C13H10BrN3O2S/c1-8-5-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3
InChIKey IRUPTZNZPHHAAH-UHFFFAOYSA-N
Mol Weight 352.21 g/mol
Molecular Formula C13H10BrN3O2S
Exact Mass 350.967711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRkT3Yeb0IK
Name 7-methyl-2-(3-bromophenoxy)methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H10BrN3O2S
InChI InChI=1S/C13H10BrN3O2S/c1-8-5-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3
InChIKey IRUPTZNZPHHAAH-UHFFFAOYSA-N
Molecular Weight 352.206 g/mol
SMILES C=12N(N=C(S2)COc2cc(Br)ccc2)C(C=C(N1)C)=O
SPLASH splash10-0udi-0009000000-55cebdbc58a176ad12dd
Source of Spectrum G2-19-219-6q
Synonyms 2-[(3-bromanylphenoxy)methyl]-7-methyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Wiley ID 1705390