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1,4-benzodioxin-6-methanaminium, 2,3-dihydro-N-(3-hydroxytricyclo[3.3.1.1~3,7~]dec-1-yl)-, chloride
SpectraBase Compound ID 9a47NxWPK55
InChI InChI=1S/C19H25NO3.ClH/c21-19-9-14-5-15(10-19)8-18(7-14,12-19)20-11-13-1-2-16-17(6-13)23-4-3-22-16;/h1-2,6,14-15,20-21H,3-5,7-12H2;1H/t14-,15+,18+,19-;
InChIKey PIBKQBLBEGGWPI-GKMGWHEUSA-N
Mol Weight 351.87 g/mol
Molecular Formula C19H26ClNO3
Exact Mass 351.160121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 82J4GdxpXlH
Name 1,4-benzodioxin-6-methanaminium, 2,3-dihydro-N-(3-hydroxytricyclo[3.3.1.1~3,7~]dec-1-yl)-, 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/C19H25NO3.ClH/c21-19-9-14-5-15(10-19)8-18(7-14,12-19)20-11-13-1-2-16-17(6-13)23-4-3-22-16;/h1-2,6,14-15,20-21H,3-5,7-12H2;1H/t14-,15+,18+,19-;
InChIKey PIBKQBLBEGGWPI-GKMGWHEUSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5597
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/17311841; Labnumber: LT-1203X3316