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

*Links on SpectraBase are not permalinks.
(3-((10-(1H-imidazol-1-yl)octadecanoyl)oxy)propyl) triphenylphosphonium bromide
SpectraBase Compound ID KEwyGZCOyvO
InChI InChI=1S/C42H58N2O2P.BrH/c1-2-3-4-5-8-14-24-38(44-34-33-43-37-44)25-15-9-6-7-10-22-32-42(45)46-35-23-36-47(39-26-16-11-17-27-39,40-28-18-12-19-29-40)41-30-20-13-21-31-41;/h11-13,16-21,26-31,33-34,37-38H,2-10,14-15,22-25,32,35-36H2,1H3;1H/q+1;/p-1
InChIKey NMZGQKKRPFTVHA-UHFFFAOYSA-M
Mol Weight 733.816 g/mol
Molecular Formula C42H58BrN2O2P
Exact Mass 732.341929 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 IhL766XQesU
Name (3-((10-(1H-imidazol-1-yl)octadecanoyl)oxy)propyl) triphenylphosphonium bromide
Appearance Gummy liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H58BrN2O2P
InChI InChI=1S/C42H58N2O2P.BrH/c1-2-3-4-5-8-14-24-38(44-34-33-43-37-44)25-15-9-6-7-10-22-32-42(45)46-35-23-36-47(39-26-16-11-17-27-39,40-28-18-12-19-29-40)41-30-20-13-21-31-41;/h11-13,16-21,26-31,33-34,37-38H,2-10,14-15,22-25,32,35-36H2,1H3;1H/q+1;/p-1
InChIKey NMZGQKKRPFTVHA-UHFFFAOYSA-M
Ionization Type EI
Molecular Weight 733.816 g/mol
SMILES C(CCCCCCC([n]1ccnc1)CCCCCCCC)CC(OCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=O.[Br-]
SPLASH splash10-0aor-9000000000-6c44e90bae748e5ab6a4
Source of Spectrum US20130203829A1
Thin-Layer Chromatography Rf = 0.45 (10% MeOH in DCM, KMnO4 and iodine active)
Wiley ID 1847751