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benzoic acid, 4-[(E)-[2,5-dioxo-1-(2-phenylethyl)-3-pyrrolidinylidene]methyl]-, methyl ester
SpectraBase Compound ID C1nr3nmNrbU
InChI InChI=1S/C21H19NO4/c1-26-21(25)17-9-7-16(8-10-17)13-18-14-19(23)22(20(18)24)12-11-15-5-3-2-4-6-15/h2-10,13H,11-12,14H2,1H3/b18-13+
InChIKey VJXLBRYKTUAUDL-QGOAFFKASA-N
Mol Weight 349.39 g/mol
Molecular Formula C21H19NO4
Exact Mass 349.131408 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6t6UYmiR9tC
Name benzoic acid, 4-[(E)-[2,5-dioxo-1-(2-phenylethyl)-3-pyrrolidinylidene]methyl]-, methyl ester
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/C21H19NO4/c1-26-21(25)17-9-7-16(8-10-17)13-18-14-19(23)22(20(18)24)12-11-15-5-3-2-4-6-15/h2-10,13H,11-12,14H2,1H3/b18-13+
InChIKey VJXLBRYKTUAUDL-QGOAFFKASA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4460
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: F20965; Labnumber: NNA-V-25754