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1,4-benzodioxin-2-methanaminium, N-[3-(4-chlorophenoxy)-2-hydroxypropyl]-2,3-dihydro-, chloride
SpectraBase Compound ID GhqzngbIJtK
InChI InChI=1S/C18H20ClNO4.ClH/c19-13-5-7-15(8-6-13)22-11-14(21)9-20-10-16-12-23-17-3-1-2-4-18(17)24-16;/h1-8,14,16,20-21H,9-12H2;1H
InChIKey LIXLMVVZTYHQJU-UHFFFAOYSA-N
Mol Weight 386.28 g/mol
Molecular Formula C18H21Cl2NO4
Exact Mass 385.084764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3ipO5RcdEe1
Name 1,4-benzodioxin-2-methanaminium, N-[3-(4-chlorophenoxy)-2-hydroxypropyl]-2,3-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/C18H20ClNO4.ClH/c19-13-5-7-15(8-6-13)22-11-14(21)9-20-10-16-12-23-17-3-1-2-4-18(17)24-16;/h1-8,14,16,20-21H,9-12H2;1H
InChIKey LIXLMVVZTYHQJU-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_100
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/11249715