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1-(4-Chlorobenzyl)-6-(p-methylphenylthio)uracil
SpectraBase Compound ID swda3lM0f3
InChI InChI=1S/C18H15ClN2O2S/c1-12-2-8-15(9-3-12)24-17-10-16(22)20-18(23)21(17)11-13-4-6-14(19)7-5-13/h2-10H,11H2,1H3,(H,20,22,23)
InChIKey KBBWABDQHQLZHH-UHFFFAOYSA-N
Mol Weight 358.84 g/mol
Molecular Formula C18H15ClN2O2S
Exact Mass 358.054277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rc5VvaAimD
Name 1-(4-Chlorobenzyl)-6-(p-methylphenylthio)uracil
Alternate Name(s) 1-(4-chlorobenzyl)-6-[(4-methylphenyl)sulfanyl]-2,4(1H,3H)-pyrimidinedione
Comments Less than 3 mono-isotopic peaks
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Formula C18H15ClN2O2S
InChI InChI=1S/C18H15ClN2O2S/c1-12-2-8-15(9-3-12)24-17-10-16(22)20-18(23)21(17)11-13-4-6-14(19)7-5-13/h2-10H,11H2,1H3,(H,20,22,23)
InChIKey KBBWABDQHQLZHH-UHFFFAOYSA-N
Molecular Weight 358.843 g/mol
SMILES N1C(C=C(N(C1=O)Cc1ccc(cc1)Cl)Sc1ccc(cc1)C)=O
SPLASH splash10-004i-0900000000-cc0ae97c9dbe16a72b05
Source of Spectrum QC-25-994-5
Wiley ID 1584360