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3,3-dimethyl-N-{2-[2-oxo-2-(3-toluidino)ethoxy]benzyl}-2-butanaminium chloride
SpectraBase Compound ID BzXUqz1HOwf
InChI InChI=1S/C22H30N2O2.ClH/c1-16-9-8-11-19(13-16)24-21(25)15-26-20-12-7-6-10-18(20)14-23-17(2)22(3,4)5;/h6-13,17,23H,14-15H2,1-5H3,(H,24,25);1H
InChIKey HHANZQVGLLOYQU-UHFFFAOYSA-N
Mol Weight 390.96 g/mol
Molecular Formula C22H31ClN2O2
Exact Mass 390.207406 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KXsPr6CXBcA
Name 3,3-dimethyl-N-{2-[2-oxo-2-(3-toluidino)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/C22H30N2O2.ClH/c1-16-9-8-11-19(13-16)24-21(25)15-26-20-12-7-6-10-18(20)14-23-17(2)22(3,4)5;/h6-13,17,23H,14-15H2,1-5H3,(H,24,25);1H
InChIKey HHANZQVGLLOYQU-UHFFFAOYSA-N
NMR Offset 17.912
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33485
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: 1928830; SBI_ID: SBI-033489
Temperature 303 °C