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5-[2-(3,4-dimethoxyphenyl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
SpectraBase Compound ID 3IM60YhdZrJ
InChI InChI=1S/C20H22F3N3O2S/c1-27-17-7-6-14(10-18(17)28-2)8-9-25-12-24-19(29)26(13-25)16-5-3-4-15(11-16)20(21,22)23/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,24,29)
InChIKey KASXVUSPLHBTSV-UHFFFAOYSA-N
Mol Weight 425.47 g/mol
Molecular Formula C20H22F3N3O2S
Exact Mass 425.138483 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rGFJNWXeJF
Name 5-[2-(3,4-dimethoxyphenyl)ethyl]-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22F3N3O2S
InChI InChI=1S/C20H22F3N3O2S/c1-27-17-7-6-14(10-18(17)28-2)8-9-25-12-24-19(29)26(13-25)16-5-3-4-15(11-16)20(21,22)23/h3-7,10-11H,8-9,12-13H2,1-2H3,(H,24,29)
InChIKey KASXVUSPLHBTSV-UHFFFAOYSA-N
Molecular Weight 425.470 g/mol
SMILES N1CN(CN(C1=S)c1cccc(c1)C(F)(F)F)CCc1ccc(c(c1)OC)OC
SPLASH splash10-0f6x-5910000000-fa3c409be05b3e482b37
Source of Spectrum IY-2-5063-0
Wiley ID 1658613