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

*Links on SpectraBase are not permalinks.
4-{(Z)-[1-(3,4-dimethylphenyl)-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
SpectraBase Compound ID Dq1xg3VAsHM
InChI InChI=1S/C23H21NO5/c1-13-5-10-18(11-14(13)2)24-15(3)20(23(28)29-4)19(21(24)25)12-16-6-8-17(9-7-16)22(26)27/h5-12H,1-4H3,(H,26,27)/b19-12-
InChIKey VGDVEUZTGQYHMC-UNOMPAQXSA-N
Mol Weight 391.42 g/mol
Molecular Formula C23H21NO5
Exact Mass 391.141973 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 Iyf8495P64U
Name 4-{(Z)-[1-(3,4-dimethylphenyl)-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
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/C23H21NO5/c1-13-5-10-18(11-14(13)2)24-15(3)20(23(28)29-4)19(21(24)25)12-16-6-8-17(9-7-16)22(26)27/h5-12H,1-4H3,(H,26,27)/b19-12-
InChIKey VGDVEUZTGQYHMC-UNOMPAQXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5495
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: D26007; Labnumber: SPDEM-3943; SBI_ID: SBI-005497
Synonyms 4-{[1-(3,4-dimethylphenyl)-4-(methoxycarbonyl)-5-methyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
Temperature 318 °C