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3-{3-hydroxy-5-(4-methylphenyl)-2-oxo-4-[(2E)-3-phenyl-2-propenoyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoic acid
SpectraBase Compound ID 11ZlaSUrXld
InChI InChI=1S/C27H21NO5/c1-17-10-13-19(14-11-17)24-23(22(29)15-12-18-6-3-2-4-7-18)25(30)26(31)28(24)21-9-5-8-20(16-21)27(32)33/h2-16,24,30H,1H3,(H,32,33)/b15-12+
InChIKey WQPLAGZZCCFATH-NTCAYCPXSA-N
Mol Weight 439.47 g/mol
Molecular Formula C27H21NO5
Exact Mass 439.141973 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6L26ULUxvUt
Name 3-{3-hydroxy-5-(4-methylphenyl)-2-oxo-4-[(2E)-3-phenyl-2-propenoyl]-2,5-dihydro-1H-pyrrol-1-yl}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/C27H21NO5/c1-17-10-13-19(14-11-17)24-23(22(29)15-12-18-6-3-2-4-7-18)25(30)26(31)28(24)21-9-5-8-20(16-21)27(32)33/h2-16,24,30H,1H3,(H,32,33)/b15-12+
InChIKey WQPLAGZZCCFATH-NTCAYCPXSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8257
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: D35518; Labnumber: RPGE-2748; SBI_ID: SBI-008260
Synonyms 3-{3-hydroxy-5-(4-methylphenyl)-2-oxo-4-[3-phenyl-2-propenoyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoic acid
Temperature 306 °C