| SpectraBase Spectrum ID |
HGUFzz3BR5G |
| Name |
Methyl 4-((4S,5R)-5-((E)-2-(1-hydroxyhexyl)styryl)-2,2-dimethyl-1,3-dioxolane-4-yl)butanoate |
| Appearance |
Yellow oil |
| Carrier Gas |
Hydrogen (30 ml/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.256274254 u |
| Formula |
C24H36O5 |
| GC Column |
Macherey-Nagel-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C24H36O5/c1-5-6-7-13-20(25)19-12-9-8-11-18(19)16-17-22-21(28-24(2,3)29-22)14-10-15-23(26)27-4/h8-9,11-12,16-17,20-22,25H,5-7,10,13-15H2,1-4H3/b17-16+/t20?,21-,22+/m0/s1 |
| InChIKey |
ZRADWSGYSFTVOF-XDZFRBPDSA-N |
| Instrument Name |
Agilent HP6890-5937N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202201424 |
| Molecular Weight |
404.547 g/mol |
| Quality |
223 |
| SMILES |
OC(C1=C(\C=C\[C@@]2([C@@](OC(O2)(C)C)(CCCC(OC)=O)[H])[H])C=CC=C1)CCCCC |
| SPLASH |
splash10-05r4-3930000000-3063fa6f1864f953df5c |
| Source of Spectrum |
K1-26-SM12-ambo-31 (DOI: 10.1002/ejoc.202201424) |
| Thin-Layer Chromatography |
0.15 (CyHex/EtOAc, 5:1) |
| Wiley ID |
1910588 |
