SpectraBase Spectrum ID |
Kbsd2Sf5SOX |
Name |
(Z)-9,10,11-Trihydroxyoctadec-12-enoic acid, 4tms derivative |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
618.398731360 u |
Formula |
C30H66O5Si4 |
InChI |
InChI=1S/C30H66O5Si4/c1-14-15-16-18-21-24-27(32-36(2,3)4)30(35-39(11,12)13)28(33-37(5,6)7)25-22-19-17-20-23-26-29(31)34-38(8,9)10/h21,24,27-28,30H,14-20,22-23,25-26H2,1-13H3/b24-21- |
InChIKey |
LRSMJHGZZWRBKH-FLFQWRMESA-N |
Molecular Weight |
619.193 g/mol |
SMILES |
C(CCCCCCCC(C(C(\C=C/CCCCC)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)(=O)O[Si](C)(C)C |