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2-(3-bromo-4-methoxybenzyl)isothiouronium

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2-(3-bromo-4-methoxybenzyl)isothiouronium
SpectraBase Compound ID Dd6phsWHIeJ
InChI InChI=1S/C9H11BrN2OS/c1-13-8-3-2-6(4-7(8)10)5-14-9(11)12/h2-4H,5H2,1H3,(H3,11,12)/p+1
InChIKey PJOVHLKPXDLXFC-UHFFFAOYSA-O
Mol Weight 276.17 g/mol
Molecular Formula C9H12BrN2OS
Exact Mass 274.985372 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1eoAelHSBCA
Name 2-(3-bromo-4-methoxybenzyl)isothiouronium
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/C9H11BrN2OS/c1-13-8-3-2-6(4-7(8)10)5-14-9(11)12/h2-4H,5H2,1H3,(H3,11,12)/p+1
InChIKey PJOVHLKPXDLXFC-UHFFFAOYSA-O
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4881
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: 112573; Labnumber: AMIR-6045; VK_ID: VK-004884
Temperature 318 °C