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benzenemethanaminium, 2,4,5-trimethoxy-N-[3-[(1-methyl-1H-tetrazol-5-yl)thio]propyl]-, chloride
SpectraBase Compound ID F2dOJ4E6SMu
InChI InChI=1S/C15H23N5O3S.ClH/c1-20-15(17-18-19-20)24-7-5-6-16-10-11-8-13(22-3)14(23-4)9-12(11)21-2;/h8-9,16H,5-7,10H2,1-4H3;1H
InChIKey XKRWUROIDWKDGU-UHFFFAOYSA-N
Mol Weight 389.9 g/mol
Molecular Formula C15H24ClN5O3S
Exact Mass 389.128839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7UTorzI9TaV
Name benzenemethanaminium, 2,4,5-trimethoxy-N-[3-[(1-methyl-1H-tetrazol-5-yl)thio]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/C15H23N5O3S.ClH/c1-20-15(17-18-19-20)24-7-5-6-16-10-11-8-13(22-3)14(23-4)9-12(11)21-2;/h8-9,16H,5-7,10H2,1-4H3;1H
InChIKey XKRWUROIDWKDGU-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3581
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: F17911; Labnumber: SPHRAM1-30822