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

*Links on SpectraBase are not permalinks.
1H-isoindole-1,3(2H)-dione, 2-[5-[1-[3-(1,3-dihydro-5-nitro-1,3-dioxo-2H-isoindol-2-yl)-4-hydroxyphenyl]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-hydroxyphenyl]-5-nitro-
SpectraBase Compound ID AoXLr2gBYGj
InChI InChI=1S/C31H14F6N4O10/c32-30(33,34)29(31(35,36)37,13-1-7-23(42)21(9-13)38-25(44)17-5-3-15(40(48)49)11-19(17)27(38)46)14-2-8-24(43)22(10-14)39-26(45)18-6-4-16(41(50)51)12-20(18)28(39)47/h1-12,42-43H
InChIKey RXWABHHGBNRKIP-UHFFFAOYSA-N
Mol Weight 716.46 g/mol
Molecular Formula C31H14F6N4O10
Exact Mass 716.061412 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HfDbmWvXoI3
Name 1H-isoindole-1,3(2H)-dione, 2-[5-[1-[3-(1,3-dihydro-5-nitro-1,3-dioxo-2H-isoindol-2-yl)-4-hydroxyphenyl]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-2-hydroxyphenyl]-5-nitro-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C31H14F6N4O10/c32-30(33,34)29(31(35,36)37,13-1-7-23(42)21(9-13)38-25(44)17-5-3-15(40(48)49)11-19(17)27(38)46)14-2-8-24(43)22(10-14)39-26(45)18-6-4-16(41(50)51)12-20(18)28(39)47/h1-12,42-43H
InChIKey RXWABHHGBNRKIP-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1021
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/5118155; Labnumber: LN-244; IOH_ID: IOH-008023