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3-isoxazolemethanaminium, 5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-, chloride
SpectraBase Compound ID BEBEZWk7STi
InChI InChI=1S/C14H18N2O5.ClH/c1-17-11-4-8(3-10-5-9(6-15)16-21-10)12(18-2)14-13(11)19-7-20-14;/h4,10H,3,5-7,15H2,1-2H3;1H
InChIKey MBEJNZKYXRSHMN-UHFFFAOYSA-N
Mol Weight 330.77 g/mol
Molecular Formula C14H19ClN2O5
Exact Mass 330.098249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9zCbDSgzo05
Name 3-isoxazolemethanaminium, 5-[(4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-, 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/C14H18N2O5.ClH/c1-17-11-4-8(3-10-5-9(6-15)16-21-10)12(18-2)14-13(11)19-7-20-14;/h4,10H,3,5-7,15H2,1-2H3;1H
InChIKey MBEJNZKYXRSHMN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5118
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/17311299; Labnumber: 144