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

*Links on SpectraBase are not permalinks.
{2-Chloro-4-cyanopentandien-3-yl o-[naphthalo[2,1-b]dihydrofuran-2-yl]phenyl-2-propenoate} dimer
SpectraBase Compound ID 8jOJCOKPeIz
InChI InChI=1S/C50H26Cl2N2O6/c51-47-40(28-54)50(60-46(56)24-20-32-12-4-8-16-36(32)44-26-38-34-14-6-2-10-30(34)18-22-42(38)58-44)48(52)39(27-53)49(47)59-45(55)23-19-31-11-3-7-15-35(31)43-25-37-33-13-5-1-9-29(33)17-21-41(37)57-43/h1-26H/b23-19-,24-20-
InChIKey BRYXWHZXMYPHAT-SRPFLQSCSA-N
Mol Weight 821.7 g/mol
Molecular Formula C50H26Cl2N2O6
Exact Mass 820.116792 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 LwTDWvECh8
Name {2-Chloro-4-cyanopentandien-3-yl o-[naphthalo[2,1-b]dihydrofuran-2-yl]phenyl-2-propenoate} dimer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H26Cl2N2O6
InChI InChI=1S/C50H26Cl2N2O6/c51-47-40(28-54)50(60-46(56)24-20-32-12-4-8-16-36(32)44-26-38-34-14-6-2-10-30(34)18-22-42(38)58-44)48(52)39(27-53)49(47)59-45(55)23-19-31-11-3-7-15-35(31)43-25-37-33-13-5-1-9-29(33)17-21-41(37)57-43/h1-26H/b23-19-,24-20-
InChIKey BRYXWHZXMYPHAT-SRPFLQSCSA-N
Molecular Weight 821.672 g/mol
SMILES c1(c(c(Cl)c(c(c1Cl)OC(\C=C/c1c(-c2cc3c4c(cccc4)ccc3o2)cccc1)=O)C#N)OC(\C=C/c1c(-c2cc3c4c(cccc4)ccc3o2)cccc1)=O)C#N
SPLASH splash10-01bj-0090010000-93b78744b44b7da01300
Source of Spectrum F-48-5492-6
Wiley ID 1417434