1,3-benzodioxole-5-methanaminium, N-[2-[[(4-amino-1,2,5-oxadiazol-3-yl)carbonyl]amino]ethyl]-, chloride

SpectraBase Compound ID	4a4sTjsfaJo
InChI	InChI=1S/C13H15N5O4.ClH/c14-12-11(17-22-18-12)13(19)16-4-3-15-6-8-1-2-9-10(5-8)21-7-20-9;/h1-2,5,15H,3-4,6-7H2,(H2,14,18)(H,16,19);1H
InChIKey	MSWRTXPSYZPSSZ-UHFFFAOYSA-N Google Search
Mol Weight	341.75 g/mol
Molecular Formula	C13H16ClN5O4
Exact Mass	341.089082 g/mol

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SpectraBase Spectrum ID	6TMv1no06Ti
Name	1,3-benzodioxole-5-methanaminium, N-[2-[[(4-amino-1,2,5-oxadiazol-3-yl)carbonyl]amino]ethyl]-, 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/C13H15N5O4.ClH/c14-12-11(17-22-18-12)13(19)16-4-3-15-6-8-1-2-9-10(5-8)21-7-20-9;/h1-2,5,15H,3-4,6-7H2,(H2,14,18)(H,16,19);1H
InChIKey	MSWRTXPSYZPSSZ-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_3503
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: F17809; Labnumber: SPHRAM1-28142