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1-(4-bromophenyl)-4-(4-methylphenyl)-2-pyrimidinethione

View entire compound with spectra: 2 MS (GC)

1-(4-bromophenyl)-4-(4-methylphenyl)-2-pyrimidinethione
SpectraBase Compound ID KATWxsHsHrv
InChI InChI=1S/C17H13BrN2S/c1-12-2-4-13(5-3-12)16-10-11-20(17(21)19-16)15-8-6-14(18)7-9-15/h2-11H,1H3
InChIKey PZGSIOSSBLADIO-UHFFFAOYSA-N
Mol Weight 357.27 g/mol
Molecular Formula C17H13BrN2S
Exact Mass 355.998283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VY9Glm9zb3
Name 1-(4-bromophenyl)-4-(4-methylphenyl)-2-pyrimidinethione
Alternate Name(s) 1-(4-bromophenyl)-4-(4-methylphenyl)pyrimidine-2-thione 1-(4-bromophenyl)-4-(p-tolyl)pyrimidine-2-thione
CAS Registry Number 131022-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrN2S
InChI InChI=1S/C17H13BrN2S/c1-12-2-4-13(5-3-12)16-10-11-20(17(21)19-16)15-8-6-14(18)7-9-15/h2-11H,1H3
InChIKey PZGSIOSSBLADIO-UHFFFAOYSA-N
Molecular Weight 357.269 g/mol
SMILES C1(N=C(c2ccc(cc2)C)C=CN1c1ccc(cc1)Br)=S
SPLASH splash10-00n0-6916000000-4e622fb7c22b9398f878
Source of Spectrum Y-27-1443-3
Wiley ID 1345605