SpectraBase Spectrum ID |
29VvEsvrFbh |
Name |
Cyclohexanone, 3-[1,1-dimethyl-3-(phenylsulfinyl)-2-propenyl]-, [R*,S*-(E)]-(.+-.)- |
CAS Registry Number |
114678-76-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H22O2S |
InChI |
InChI=1S/C17H22O2S/c1-17(2,14-7-6-8-15(18)13-14)11-12-20(19)16-9-4-3-5-10-16/h3-5,9-12,14H,6-8,13H2,1-2H3/b12-11+/t14-,20?/m0/s1 |
InChIKey |
WIFMVFHWJUXSFF-XBKXKYASSA-N |
Molecular Weight |
290.421 g/mol |
SMILES |
C(\C=C\[S@@](=O)c1ccccc1)([C@@]1(CC(=O)CCC1)[H])(C)C |
SPLASH |
splash10-056s-0900000000-86ecca69a88626aa2135 |
Source of Spectrum |
C-110-5420-46 |
Synonyms |
(2'E,3RS,SSRS)-3-[1',1-dimethyl-3'-(phenylsulfinyl)prop-2'-enyl]cyclohexanone
(3S)-3-[(2E)-1,1-dimethyl-3-(phenylsulfinyl)-2-propenyl]cyclohexanone |
Wiley ID |
1293675 |