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1,4-benzodioxin-2-methanaminium, 2,3-dihydro-N,N-bis(3-oxobutyl)-, chloride

View entire compound with spectra: 1 NMR

1,4-benzodioxin-2-methanaminium, 2,3-dihydro-N,N-bis(3-oxobutyl)-, chloride
SpectraBase Compound ID JzrlSvk81MV
InChI InChI=1S/C17H23NO4.ClH/c1-13(19)7-9-18(10-8-14(2)20)11-15-12-21-16-5-3-4-6-17(16)22-15;/h3-6,15H,7-12H2,1-2H3;1H
InChIKey MXFKWVDYKPALSM-UHFFFAOYSA-N
Mol Weight 341.84 g/mol
Molecular Formula C17H24ClNO4
Exact Mass 341.139386 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4J73hsK9TOk
Name 1,4-benzodioxin-2-methanaminium, 2,3-dihydro-N,N-bis(3-oxobutyl)-, 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/C17H23NO4.ClH/c1-13(19)7-9-18(10-8-14(2)20)11-15-12-21-16-5-3-4-6-17(16)22-15;/h3-6,15H,7-12H2,1-2H3;1H
InChIKey MXFKWVDYKPALSM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_115
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/11249736