For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
12-hydroxyoctadecanoic acid, PFB-TMS derivative
SpectraBase Compound ID FmTAajDuYLk
InChI InChI=1S/C28H45F5O3Si/c1-5-6-7-14-17-21(36-37(2,3)4)18-15-12-10-8-9-11-13-16-19-23(34)35-20-22-24(29)26(31)28(33)27(32)25(22)30/h21H,5-20H2,1-4H3
InChIKey SZOWBCQKOCUOQB-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C28H45F5O3Si
Exact Mass 552.305813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FdWadyvmWZe
Name 12-hydroxyoctadecanoic acid, PFB-TMS derivative
Alternate Name(s) 2,3,4,5,6-pentafluorobenzyl 12-[(trimethylsilyl)oxy]octadecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H45F5O3Si
InChI InChI=1S/C28H45F5O3Si/c1-5-6-7-14-17-21(36-37(2,3)4)18-15-12-10-8-9-11-13-16-19-23(34)35-20-22-24(29)26(31)28(33)27(32)25(22)30/h21H,5-20H2,1-4H3
InChIKey SZOWBCQKOCUOQB-UHFFFAOYSA-N
Molecular Weight 552.742 g/mol
SMILES c1(c(c(F)c(c(c1F)F)F)F)COC(=O)CCCCCCCCCCC(O[Si](C)(C)C)CCCCCC
SPLASH splash10-000i-1900300000-0012ee05476010f14a8a
Source of Spectrum JA-6-40-0
Wiley ID 1405934