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1,3,5-Tris(4-chlorophenyl)-1,3,5-triazinane-2-thione

View entire compound with spectra: 1 MS (GC)

1,3,5-Tris(4-chlorophenyl)-1,3,5-triazinane-2-thione
SpectraBase Compound ID 4Gu7w3Asijj
InChI InChI=1S/C21H16Cl3N3S/c22-15-1-7-18(8-2-15)25-13-26(19-9-3-16(23)4-10-19)21(28)27(14-25)20-11-5-17(24)6-12-20/h1-12H,13-14H2
InChIKey HOXWLSMZAOBTHY-UHFFFAOYSA-N
Mol Weight 448.8 g/mol
Molecular Formula C21H16Cl3N3S
Exact Mass 447.013052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HM2cT32swAS
Name 1,3,5-Tris(4-chlorophenyl)-1,3,5-triazinane-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16Cl3N3S
InChI InChI=1S/C21H16Cl3N3S/c22-15-1-7-18(8-2-15)25-13-26(19-9-3-16(23)4-10-19)21(28)27(14-25)20-11-5-17(24)6-12-20/h1-12H,13-14H2
InChIKey HOXWLSMZAOBTHY-UHFFFAOYSA-N
Molecular Weight 448.799 g/mol
SMILES C1(N(CN(CN1c1ccc(cc1)Cl)c1ccc(cc1)Cl)c1ccc(cc1)Cl)=S
SPLASH splash10-000i-0900000000-de439c15510b4d9cdcf1
Source of Spectrum KC-0-1648-8
Wiley ID 781470