SpectraBase Spectrum ID |
6wGhZmhfpZb |
Name |
[1'S,1S,2S]1-[1'-(Ethoxycarbonyl)ethyl]-2-(p-tolylsulfenyl)cyclohexanol |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H26O3S |
InChI |
InChI=1S/C18H26O3S/c1-4-21-17(19)14(3)18(20)12-6-5-7-16(18)22-15-10-8-13(2)9-11-15/h8-11,14,16,20H,4-7,12H2,1-3H3/t14-,16+,18+/m1/s1 |
InChIKey |
SGIVABZCPZQEBI-HFTRVMKXSA-N |
Molecular Weight |
322.463 g/mol |
SMILES |
O[C@@]1([C@@](C(=O)OCC)(C)[H])[C@@](Sc2ccc(cc2)C)(CCCC1)[H] |
SPLASH |
splash10-00di-5914000000-061a28d088cbb30bf8d7 |
Source of Spectrum |
J-61-9469-14 |
Synonyms |
Ethyl (2S)-2-{(1S,2S)-1-hydroxy-2-[(4-methylphenyl)sulfanyl]cyclohexyl}propanoate
(2S)-2-[(1S,2S)-1-hydroxy-2-[(4-methylphenyl)thio]cyclohexyl]propanoic acid ethyl ester
Ethyl (2S)-2-[(1S,2S)-1-hydroxy-2-(4-methylphenyl)sulfanylcyclohexyl]propanoate
Ethyl (2S)-2-[(1S,2S)-1-hydroxy-2-(p-tolylsulfanyl)cyclohexyl]propanoate
Ethyl (2S)-2-[(1S,2S)-2-(4-methylphenyl)sulfanyl-1-oxidanyl-cyclohexyl]propanoate |
Wiley ID |
1321693 |