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

*Links on SpectraBase are not permalinks.
CIS-9-OCTADECENE-1-O-BIS(CHOLESTERYL-3-O-)THIOPHOSPHATE
SpectraBase Compound ID KOMRtKEZ7Hu
InChI InChI=1S/C72H125O3PS/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-50-73-76(77,74-59-42-46-69(8)57(51-59)34-36-61-65-40-38-63(55(6)32-28-30-53(2)3)71(65,10)48-44-67(61)69)75-60-43-47-70(9)58(52-60)35-37-62-66-41-39-64(56(7)33-29-31-54(4)5)72(66,11)49-45-68(62)70/h19-20,34-35,53-56,59-68H,12-18,21-33,36-52H2,1-11H3/b20-19-/t55?,56?,59?,60?,61?,62?,63?,64?,65?,66?,67?,68?,69-,70-,71+,72+,76?/m1/s1
InChIKey AFDDLTJOOTTYHU-CVTRZHDNSA-N
Mol Weight 1101.8 g/mol
Molecular Formula C72H125O3PS
Exact Mass 1100.908706 g/mol
Enantiomer InChIKey AFDDLTJOOTTYHU-VONKIMSTSA-N
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent C6D6 benzene-d6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent C6D6 benzene-d6

This compound is available in the following databases:

KnowItAll NMR Spectral Library

Author: Wiley

The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.

Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.