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2-((3-nitro-4-propoxybenzyl)thio)-4,5-dihydro-1H-imidazol-3-ium chloride

View entire compound with spectra: 1 NMR

2-((3-nitro-4-propoxybenzyl)thio)-4,5-dihydro-1H-imidazol-3-ium chloride
SpectraBase Compound ID 7rCBlGD3JvZ
InChI InChI=1S/C13H17N3O3S.ClH/c1-2-7-19-12-4-3-10(8-11(12)16(17)18)9-20-13-14-5-6-15-13;/h3-4,8H,2,5-7,9H2,1H3,(H,14,15);1H
InChIKey DDVCGCOYRNZIFD-UHFFFAOYSA-N
Mol Weight 331.82 g/mol
Molecular Formula C13H18ClN3O3S
Exact Mass 331.07574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1sJlx83dS4w
Name 2-((3-nitro-4-propoxybenzyl)thio)-4,5-dihydro-1H-imidazol-3-ium 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/C13H17N3O3S.ClH/c1-2-7-19-12-4-3-10(8-11(12)16(17)18)9-20-13-14-5-6-15-13;/h3-4,8H,2,5-7,9H2,1H3,(H,14,15);1H
InChIKey DDVCGCOYRNZIFD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7340
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/12238723