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1-(2-(morpholino-4-ium)ethyl)-4-(4-(morpholinosulfonyl)benzoyl)-2-oxo-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-3-olate
SpectraBase Compound ID 88l8ADYdXIj
InChI InChI=1S/C25H29N3O7S2/c29-23(18-3-5-19(6-4-18)37(32,33)27-11-15-35-16-12-27)21-22(20-2-1-17-36-20)28(25(31)24(21)30)8-7-26-9-13-34-14-10-26/h1-6,17,22,30H,7-16H2
InChIKey HQCNCTYGULYRDC-UHFFFAOYSA-N
Mol Weight 547.64 g/mol
Molecular Formula C25H29N3O7S2
Exact Mass 547.144693 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Q8EyH2kMov
Name 1-(2-(morpholino-4-ium)ethyl)-4-(4-(morpholinosulfonyl)benzoyl)-2-oxo-5-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-3-olate
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/C25H29N3O7S2/c29-23(18-3-5-19(6-4-18)37(32,33)27-11-15-35-16-12-27)21-22(20-2-1-17-36-20)28(25(31)24(21)30)8-7-26-9-13-34-14-10-26/h1-6,17,22,30H,7-16H2
InChIKey HQCNCTYGULYRDC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1959
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/11268432