| SpectraBase Spectrum ID |
CVmBbZPmIiM |
| Name |
(4S,5R)-4-(ethylthio)carbonyl-5-hydroxy-7-methyl-caprylic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H26O4S |
| InChI |
InChI=1S/C14H26O4S/c1-5-18-13(16)8-7-11(14(17)19-6-2)12(15)9-10(3)4/h10-12,15H,5-9H2,1-4H3/t11-,12+/m0/s1 |
| InChIKey |
ICWXDAKORCJICD-NWDGAFQWSA-N |
| Molecular Weight |
290.418 g/mol |
| SMILES |
O[C@@]([C@@](C(=O)SCC)(CCC(=O)OCC)[H])(CC(C)C)[H] |
| SPLASH |
splash10-05mx-9200000000-f9fe47d3b55c6010654c |
| Source of Spectrum |
KC-0-3624-3 |
| Synonyms |
(4S,5R)-4-[(ethylthio)-oxomethyl]-5-hydroxy-7-methyloctanoic acid ethyl ester
Ethyl (4S,5R)-4-ethylsulfanylcarbonyl-7-methyl-5-oxidanyl-octanoate
Ethyl (4S,5R)-4-ethylsulfanylcarbonyl-5-hydroxy-7-methyloctanoate |
| Wiley ID |
831919 |
