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1-(4-bromanyl-3,3-dimethyl-butyl)-3-methyl-6-phenylsulfanyl-pyrimidine-2,4-dione
SpectraBase Compound ID 119u2WMIuHH
InChI InChI=1S/C17H21BrN2O2S/c1-17(2,12-18)9-10-20-15(11-14(21)19(3)16(20)22)23-13-7-5-4-6-8-13/h4-8,11H,9-10,12H2,1-3H3
InChIKey KYUGEIXNBOTEKL-UHFFFAOYSA-N
Mol Weight 397.33 g/mol
Molecular Formula C17H21BrN2O2S
Exact Mass 396.050712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzclYDJs9NS
Name 1-(4-bromanyl-3,3-dimethyl-butyl)-3-methyl-6-phenylsulfanyl-pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21BrN2O2S
InChI InChI=1S/C17H21BrN2O2S/c1-17(2,12-18)9-10-20-15(11-14(21)19(3)16(20)22)23-13-7-5-4-6-8-13/h4-8,11H,9-10,12H2,1-3H3
InChIKey KYUGEIXNBOTEKL-UHFFFAOYSA-N
Molecular Weight 397.331 g/mol
SMILES C1(N(C(=CC(N1C)=O)Sc1ccccc1)CCC(CBr)(C)C)=O
SPLASH splash10-0a59-9342000000-3486164b0c67644ba19c
Source of Spectrum KC-0-3594-11
Synonyms 1-(4-bromo-3,3-dimethyl-butyl)-3-methyl-6-(phenylthio)pyrimidine-2,4-quinone 1-(4-bromo-3,3-dimethyl-butyl)-3-methyl-6-phenylsulfanyl-pyrimidine-2,4-dione 1-(4-bromo-3,3-dimethylbutyl)-3-methyl-6-(phenylthio)pyrimidine-2,4-dione
Wiley ID 824038