| SpectraBase Spectrum ID |
B7w5wV5ovis |
| Name |
Pentafluorophenylmethyl 5-(trimethylsiloxy)eicosan-6(E),8(Z),11(Z),14(Z)-tetraenoate |
| Comments |
Original formula: C30H41F5O[18O]2Si; Note: The molecular formula of the structure shown is C30H41F5O3Si - which differs from the formula reported for the mass spectrum (C30H41F5O[18O]2Si) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H41F5O3Si |
| InChI |
InChI=1S/C30H41F5O3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23(38-39(2,3)4)20-18-21-25(36)37-22-24-26(31)28(33)30(35)29(34)27(24)32/h9-10,12-13,15-17,19,23H,5-8,11,14,18,20-22H2,1-4H3/b10-9-,13-12-,16-15-,19-17+ |
| InChIKey |
GSCKPSMECBMTCU-QQMIBWLESA-N |
| Molecular Weight |
572.732 g/mol |
| SMILES |
c1(c(c(F)c(c(c1F)F)F)F)COC(=O)CCCC(O[Si](C)(C)C)\C=C\C=C/C\C=C/C\C=C/CCCCC |
| SPLASH |
splash10-0089-9700000000-f514082bf292f4c8bd9f |
| Source of Spectrum |
B3-0-45-2 |
| Synonyms |
2,3,4,5,6-pentafluorobenzyl (6E,8Z,11Z,14Z)-5-[(trimethylsilyl)oxy]-6,8,11,14-icosatetraenoate |
| Wiley ID |
1407853 |
