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6-(2,4-Dihydroxy-phenyl)-4,4,6-trimethyl-1-(4-trifluoromethyl-phenyl)-tetrahydro-pyrimidine-2-thione
SpectraBase Compound ID 938uCB72AZT
InChI InChI=1S/C20H21F3N2O2S/c1-18(2)11-19(3,15-9-8-14(26)10-16(15)27)25(17(28)24-18)13-6-4-12(5-7-13)20(21,22)23/h4-10,26-27H,11H2,1-3H3,(H,24,28)
InChIKey LTZRLNYRSHAZHG-UHFFFAOYSA-N
Mol Weight 410.46 g/mol
Molecular Formula C20H21F3N2O2S
Exact Mass 410.127584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lJ47fc6WYv
Name 6-(2,4-Dihydroxy-phenyl)-4,4,6-trimethyl-1-(4-trifluoromethyl-phenyl)-tetrahydro-pyrimidine-2-thione
Alternate Name(s) 4-(2',4'-Dihydroxyphenyl)-1-[p-(trifluoromethyl)phenyl]-4,6,6-trimethyl-2,4-dihydropyrimidine-2(1H)-thione 6-(2,4-dihydroxyphenyl)-4,4,6-trimethyl-1-[4-(trifluoromethyl)phenyl]tetrahydro-2(1H)-pyrimidinethione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F3N2O2S
InChI InChI=1S/C20H21F3N2O2S/c1-18(2)11-19(3,15-9-8-14(26)10-16(15)27)25(17(28)24-18)13-6-4-12(5-7-13)20(21,22)23/h4-10,26-27H,11H2,1-3H3,(H,24,28)
InChIKey LTZRLNYRSHAZHG-UHFFFAOYSA-N
Molecular Weight 410.455 g/mol
SMILES Oc1ccc(c(c1)O)C1(N(C(NC(C1)(C)C)=S)c1ccc(C(F)(F)F)cc1)C
SPLASH splash10-0ufr-0940000000-4eef06205db6ee8ca02b
Source of Spectrum MN-1999-253-2
Wiley ID 1546387