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

*Links on SpectraBase are not permalinks.
PETROTRIYNDIOL
SpectraBase Compound ID DwaAf197BKm
InChI InChI=1S/C46H72O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-34-37-40-43-46(48)44-41-38-35-32-31-33-36-39-42-45(47)4-2/h1-2,5-6,21-22,27-28,39-40,42-43,45-48H,7-20,23-26,29-38H2/b6-5+,22-21+,28-27+,42-39+,43-40+/t45-,46-/m1/s1
InChIKey RWNBIJPLTYHBMT-VUESWVKYSA-N
Mol Weight 657.1 g/mol
Molecular Formula C46H72O2
Exact Mass 656.553232 g/mol
Enantiomer InChIKey RWNBIJPLTYHBMT-WQJORTPDSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
Title Journal or Book Year
Additional Cytotoxic Polyacetylenes from the Marine Sponge Petrosia Species Journal of Natural Products 2000

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.