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1-hydroxy-N-(3-methoxy-4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzyl)-2-butanaminium chloride
SpectraBase Compound ID 9zyB1FMbhyI
InChI InChI=1S/C22H30N2O4.ClH/c1-4-19(14-25)23-13-17-10-11-20(21(12-17)27-3)28-15-22(26)24-16(2)18-8-6-5-7-9-18;/h5-12,16,19,23,25H,4,13-15H2,1-3H3,(H,24,26);1H
InChIKey QPHKCKJASUZBQN-UHFFFAOYSA-N
Mol Weight 422.95 g/mol
Molecular Formula C22H31ClN2O4
Exact Mass 422.197235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5CRkhresoyV
Name 1-hydroxy-N-(3-methoxy-4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzyl)-2-butanaminium chloride
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/C22H30N2O4.ClH/c1-4-19(14-25)23-13-17-10-11-20(21(12-17)27-3)28-15-22(26)24-16(2)18-8-6-5-7-9-18;/h5-12,16,19,23,25H,4,13-15H2,1-3H3,(H,24,26);1H
InChIKey QPHKCKJASUZBQN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31558
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: 1843017; SBI_ID: SBI-031562
Temperature 306 °C