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4-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoic acid
SpectraBase Compound ID 8prdo1rHXLY
InChI InChI=1S/C21H19NO7/c1-11(23)17-18(13-6-9-15(28-2)16(10-13)29-3)22(20(25)19(17)24)14-7-4-12(5-8-14)21(26)27/h4-10,18,24H,1-3H3,(H,26,27)
InChIKey PDMQOJQHAOIIAI-UHFFFAOYSA-N
Mol Weight 397.38 g/mol
Molecular Formula C21H19NO7
Exact Mass 397.116152 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4LQRXIKrc00
Name 4-[3-acetyl-2-(3,4-dimethoxyphenyl)-4-hydroxy-5-oxo-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/C21H19NO7/c1-11(23)17-18(13-6-9-15(28-2)16(10-13)29-3)22(20(25)19(17)24)14-7-4-12(5-8-14)21(26)27/h4-10,18,24H,1-3H3,(H,26,27)
InChIKey PDMQOJQHAOIIAI-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23782
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: D43929; Labnumber: RPGE-0883; SBI_ID: SBI-023786
Temperature 306 °C