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1-(2-(morpholino-4-ium)ethyl)-4-(4-(morpholinosulfonyl)benzoyl)-2-oxo-5-phenyl-2,5-dihydro-1H-pyrrol-3-olate
SpectraBase Compound ID IOkcK1RUZ6j
InChI InChI=1S/C27H31N3O7S/c31-25(21-6-8-22(9-7-21)38(34,35)29-14-18-37-19-15-29)23-24(20-4-2-1-3-5-20)30(27(33)26(23)32)11-10-28-12-16-36-17-13-28/h1-9,24,32H,10-19H2
InChIKey RZSMQAMZSLWEQA-UHFFFAOYSA-N
Mol Weight 541.62 g/mol
Molecular Formula C27H31N3O7S
Exact Mass 541.188272 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5FWG0uAsmt5
Name 1-(2-(morpholino-4-ium)ethyl)-4-(4-(morpholinosulfonyl)benzoyl)-2-oxo-5-phenyl-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/C27H31N3O7S/c31-25(21-6-8-22(9-7-21)38(34,35)29-14-18-37-19-15-29)23-24(20-4-2-1-3-5-20)30(27(33)26(23)32)11-10-28-12-16-36-17-13-28/h1-9,24,32H,10-19H2
InChIKey RZSMQAMZSLWEQA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1957
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/11268430