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1H-pyrrole-3-carboxylic acid, 4-(1,3-benzodioxol-5-ylmethylene)-4,5-dihydro-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID 2SpHzyxLrrb
InChI InChI=1S/C23H21NO5/c1-14-4-6-16(7-5-14)12-24-15(2)21(23(26)27-3)18(22(24)25)10-17-8-9-19-20(11-17)29-13-28-19/h4-11H,12-13H2,1-3H3/b18-10-
InChIKey YRZPNULKQNAGAT-ZDLGFXPLSA-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

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SpectraBase Spectrum ID Dv5Xez6Buqe
Name 1H-pyrrole-3-carboxylic acid, 4-(1,3-benzodioxol-5-ylmethylene)-4,5-dihydro-2-methyl-1-[(4-methylphenyl)methyl]-5-oxo-, methyl ester, (4Z)-
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/c1-14-4-6-16(7-5-14)12-24-15(2)21(23(26)27-3)18(22(24)25)10-17-8-9-19-20(11-17)29-13-28-19/h4-11H,12-13H2,1-3H3/b18-10-
InChIKey YRZPNULKQNAGAT-ZDLGFXPLSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2055
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: NMR/11238267