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

*Links on SpectraBase are not permalinks.
acetic acid, [4-[3-benzoyl-2-[4-(1,1-dimethylethyl)phenyl]-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
SpectraBase Compound ID LDk3LlY3YPL
InChI InChI=1S/C29H27NO6/c1-29(2,3)20-11-9-18(10-12-20)25-24(26(33)19-7-5-4-6-8-19)27(34)28(35)30(25)21-13-15-22(16-14-21)36-17-23(31)32/h4-16,25,34H,17H2,1-3H3,(H,31,32)
InChIKey VUBGBKFJNQLYMN-UHFFFAOYSA-N
Mol Weight 485.54 g/mol
Molecular Formula C29H27NO6
Exact Mass 485.183838 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 C3tq7LxNJ2u
Name acetic acid, [4-[3-benzoyl-2-[4-(1,1-dimethylethyl)phenyl]-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 485.183837587 u
Formula C29H27NO6
InChI InChI=1S/C29H27NO6/c1-29(2,3)20-11-9-18(10-12-20)25-24(26(33)19-7-5-4-6-8-19)27(34)28(35)30(25)21-13-15-22(16-14-21)36-17-23(31)32/h4-16,25,34H,17H2,1-3H3,(H,31,32)
InChIKey VUBGBKFJNQLYMN-UHFFFAOYSA-N
Molecular Weight 485.536 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17927
Solvent DMSO-d6
Source Vendor ID: NMR/11240406; Lab Info: GEI; Lab Number: GEI-G008070