1,4-benzodioxin-2-methanaminium, 2,3-dihydro-N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-, chloride

SpectraBase Compound ID	3z9Ghxz3Ady
InChI	InChI=1S/C18H20N2O6.ClH/c21-14(11-24-15-7-5-13(6-8-15)20(22)23)9-19-10-16-12-25-17-3-1-2-4-18(17)26-16;/h1-8,14,16,19,21H,9-12H2;1H
InChIKey	UDPLOTJTYPXMGJ-UHFFFAOYSA-N Google Search
Mol Weight	396.83 g/mol
Molecular Formula	C18H21ClN2O6
Exact Mass	396.108814 g/mol

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SpectraBase Spectrum ID	Djq1uB6aOIH
Name	1,4-benzodioxin-2-methanaminium, 2,3-dihydro-N-[2-hydroxy-3-(4-nitrophenoxy)propyl]-, 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/C18H20N2O6.ClH/c21-14(11-24-15-7-5-13(6-8-15)20(22)23)9-19-10-16-12-25-17-3-1-2-4-18(17)26-16;/h1-8,14,16,19,21H,9-12H2;1H
InChIKey	UDPLOTJTYPXMGJ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_101
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/11249716