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5-Methyl-2-phenyl-5-(2-phenylethyl)-1,2,4-triazolidine-3-thione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-Methyl-2-phenyl-5-(2-phenylethyl)-1,2,4-triazolidine-3-thione
SpectraBase Compound ID Ka2RM3jGBbv
InChI InChI=1S/C17H19N3S/c1-17(13-12-14-8-4-2-5-9-14)18-16(21)20(19-17)15-10-6-3-7-11-15/h2-11,19H,12-13H2,1H3,(H,18,21)
InChIKey VXNOGTKFWDNXCN-UHFFFAOYSA-N
Mol Weight 297.42 g/mol
Molecular Formula C17H19N3S
Exact Mass 297.129969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6bvAObHY16S
Name 5-Methyl-2-phenyl-5-(2-phenylethyl)-1,2,4-triazolidine-3-thione
Alternate Name(s) 1,3,5-Triazolidine-2-thione, 5-methyl-2-phenyl-5-(2-phenylethyl)- 5-Methyl-5-phenethyl-2-phenyl-1,2,4-triazolidine-3-thione
CAS Registry Number 39263-75-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N3S
InChI InChI=1S/C17H19N3S/c1-17(13-12-14-8-4-2-5-9-14)18-16(21)20(19-17)15-10-6-3-7-11-15/h2-11,19H,12-13H2,1H3,(H,18,21)
InChIKey VXNOGTKFWDNXCN-UHFFFAOYSA-N
Molecular Weight 297.420 g/mol
SMILES N1C(NC(N1c1ccccc1)=S)(CCc1ccccc1)C
SPLASH splash10-0006-9830000000-8fb049e39dd19e9bccd0
Source of Spectrum AD-0-2532-0
Wiley ID 1430726