SpectraBase Spectrum ID |
LG2I07xCx41 |
Name |
Cyclopentanone, 3-(1,1-dimethylethoxy)-4-[1-[2-[(1,1-dimethylethyl)thio]ethenyl]hexyl]-, [3.alpha.,4.beta.[R*(E)]]- |
CAS Registry Number |
112775-24-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H38O2S |
InChI |
InChI=1S/C21H38O2S/c1-8-9-10-11-16(12-13-24-21(5,6)7)18-14-17(22)15-19(18)23-20(2,3)4/h12-13,16,18-19H,8-11,14-15H2,1-7H3/b13-12+/t16?,18-,19-/m0/s1 |
InChIKey |
IILKHAVNKAQHAY-OLARCKHOSA-N |
Molecular Weight |
354.593 g/mol |
SMILES |
[C@@]1([C@@](CC(C1)=O)(C(\C=C\SC(C)(C)C)CCCCC)[H])(OC(C)(C)C)[H] |
SPLASH |
splash10-0a4l-9210000000-3da9a3100c8d1d673f71 |
Source of Spectrum |
B-40-960-24 |
Synonyms |
(1'R(*),2'E,3S(*),4R(*))-3-t-butoxy-4-[3'-(t-butylthio)-1'-pentylprop-2'-enyl]cyclopentanone 354
(1'R(*),2E,3R(*),4S(*))-3-t-butoxy-4-[3'-(t-butylthio)-1'-pentylprop-2'-enyl]cyclopentanone
(3S,4S)-3-tert-butoxy-4-[(2E)-3-(tert-butylsulfanyl)-1-pentyl-2-propenyl]cyclopentanone |
Wiley ID |
1344799 |