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1H-pyrrole-3-carboxylic acid, 4,5-dihydro-2-methyl-1-[4-(1-methylethyl)phenyl]-4-[(3-methyl-2-thienyl)methylene]-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID LbSmnDKvbtL
InChI InChI=1S/C22H23NO3S/c1-13(2)16-6-8-17(9-7-16)23-15(4)20(22(25)26-5)18(21(23)24)12-19-14(3)10-11-27-19/h6-13H,1-5H3/b18-12-
InChIKey XVXIANMTKRLBPN-PDGQHHTCSA-N
Mol Weight 381.49 g/mol
Molecular Formula C22H23NO3S
Exact Mass 381.139865 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2q2X3eTpnFu
Name 1H-pyrrole-3-carboxylic acid, 4,5-dihydro-2-methyl-1-[4-(1-methylethyl)phenyl]-4-[(3-methyl-2-thienyl)methylene]-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/C22H23NO3S/c1-13(2)16-6-8-17(9-7-16)23-15(4)20(22(25)26-5)18(21(23)24)12-19-14(3)10-11-27-19/h6-13H,1-5H3/b18-12-
InChIKey XVXIANMTKRLBPN-PDGQHHTCSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2054
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/11238266