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2-(3,4-Dimethylphenyl)-5,5-dipropyl-1,2,4-triazolidine-3-thione
SpectraBase Compound ID KqXcNGnmeD0
InChI InChI=1S/C16H25N3S/c1-5-9-16(10-6-2)17-15(20)19(18-16)14-8-7-12(3)13(4)11-14/h7-8,11,18H,5-6,9-10H2,1-4H3,(H,17,20)
InChIKey QXYVHWQVFHZKBK-UHFFFAOYSA-N
Mol Weight 291.46 g/mol
Molecular Formula C16H25N3S
Exact Mass 291.176919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fe7IljCTyXK
Name 2-(3,4-Dimethylphenyl)-5,5-dipropyl-1,2,4-triazolidine-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25N3S
InChI InChI=1S/C16H25N3S/c1-5-9-16(10-6-2)17-15(20)19(18-16)14-8-7-12(3)13(4)11-14/h7-8,11,18H,5-6,9-10H2,1-4H3,(H,17,20)
InChIKey QXYVHWQVFHZKBK-UHFFFAOYSA-N
Molecular Weight 291.457 g/mol
SMILES N1C(NC(N1c1cc(C)c(cc1)C)=S)(CCC)CCC
SPLASH splash10-006x-9620000000-3a394efaf646698656f8
Wiley ID 1465722