SpectraBase Spectrum ID |
CvC2UO2eeuP |
Name |
O-5-{trans-4-[trans-4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}pentyl S-methyl dithiocarbonate |
Alternate Name(s) |
[(5-{4-[4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}pentyl)oxy](methylsulfanyl)methanethione |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H36F2OS2 |
InChI |
InChI=1S/C25H36F2OS2/c1-30-25(29)28-16-4-2-3-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-15-23(26)24(27)17-22/h14-15,17-21H,2-13,16H2,1H3/t18-,19-,20?,21? |
InChIKey |
NLHFISQTQITNKZ-GOHCJOFJSA-N |
Molecular Weight |
454.679 g/mol |
SMILES |
C(=S)(SC)OCCCCC[C@]1(CC[C@](C2CCC(c3cc(F)c(cc3)F)CC2)(CC1)[H])[H] |
SPLASH |
splash10-00nb-7902000000-e7745bbcd924375ad0ae |
Source of Spectrum |
AJ-73-1885-5 |
Wiley ID |
775567 |