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O-{trans-4-[trans-4(3,4-Difluorophenyl)cyclohexyl]cyclohexyl} S-Methyl Dithiocarbonate
SpectraBase Compound ID 41JfnKk6P6W
InChI InChI=1S/C20H26F2OS2/c1-25-20(24)23-17-9-6-14(7-10-17)13-2-4-15(5-3-13)16-8-11-18(21)19(22)12-16/h8,11-15,17H,2-7,9-10H2,1H3/t13?,14-,15?,17-
InChIKey KBNSZUKSDJKFNB-LVOYWBNUSA-N
Mol Weight 384.54 g/mol
Molecular Formula C20H26F2OS2
Exact Mass 384.139314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtbOpUhPirD
Name O-{trans-4-[trans-4(3,4-Difluorophenyl)cyclohexyl]cyclohexyl} S-Methyl Dithiocarbonate
Alternate Name(s) ({4-[4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}oxy)(methylsulfanyl)methanethione O-{trans-4-[trans-4(3,4-Sifluorophenyl)cyclohexyl]cyclohexyl} S-Methyl Dithiocarbonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26F2OS2
InChI InChI=1S/C20H26F2OS2/c1-25-20(24)23-17-9-6-14(7-10-17)13-2-4-15(5-3-13)16-8-11-18(21)19(22)12-16/h8,11-15,17H,2-7,9-10H2,1H3/t13?,14-,15?,17-
InChIKey KBNSZUKSDJKFNB-LVOYWBNUSA-N
Molecular Weight 384.544 g/mol
SMILES C(=S)(O[C@]1(CC[C@](C2CCC(c3cc(F)c(cc3)F)CC2)(CC1)[H])[H])SC
SPLASH splash10-0059-8920000000-6d71957117e4524644e6
Source of Spectrum AJ-73-479-2
Wiley ID 775293