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amino(3-propylthioureido)methaniminium 4-methylbenzenesulfonate

View entire compound with spectra: 1 NMR

amino(3-propylthioureido)methaniminium 4-methylbenzenesulfonate
SpectraBase Compound ID HPtYNOh4y3y
InChI InChI=1S/C7H8O3S.C5H12N4S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-8-5(10)9-4(6)7/h2-5H,1H3,(H,8,9,10);2-3,6-7H2,1H3,(H-,8,9,10)
InChIKey ZFIBKTKADYWAMK-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C12H20N4O3S2
Exact Mass 332.097683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID nHa0ikO1Ce
Name amino(3-propylthioureido)methaniminium 4-methylbenzenesulfonate
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/C7H8O3S.C5H12N4S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-8-5(10)9-4(6)7/h2-5H,1H3,(H,8,9,10);2-3,6-7H2,1H3,(H-,8,9,10)
InChIKey ZFIBKTKADYWAMK-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17956
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: 987/00006466; Labnumber: 987/00006466218879; VK_ID: VK-017963
Temperature 308 °C