SpectraBase Spectrum ID |
IMs0mgLjJP0 |
Name |
O-3-{trans-4-[4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}propyl S-methyl dithiocarbonate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H32F2OS2 |
InChI |
InChI=1S/C23H32F2OS2/c1-28-23(27)26-14-2-3-16-4-6-17(7-5-16)18-8-10-19(11-9-18)20-12-13-21(24)22(25)15-20/h12-13,15-19H,2-11,14H2,1H3/t16-,17-,18?,19? |
InChIKey |
TVFYNQFNXPHUHN-POSCCBCBSA-N |
Molecular Weight |
426.625 g/mol |
SMILES |
C(=S)(SC)OCCC[C@]1(CC[C@](C2CCC(c3cc(F)c(cc3)F)CC2)(CC1)[H])[H] |
SPLASH |
splash10-016r-6903000000-4a0979d3f43b3060fdb9 |
Source of Spectrum |
AJ-73-1885-5 |
Synonyms |
(3-{4-[4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}propoxy)(methylsulfanyl)methanethione
O-3-{trans-4-(3,4-Difluorophenyl)cyclohexyl]cyclohexyl}propyl S-methyl dithiocarbonate |
Wiley ID |
775569 |