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methyl 4-[({[3-(dimethylamino)propyl]amino}carbothioyl)amino]benzoate
SpectraBase Compound ID JNGRfUNfoU3
InChI InChI=1S/C14H21N3O2S/c1-17(2)10-4-9-15-14(20)16-12-7-5-11(6-8-12)13(18)19-3/h5-8H,4,9-10H2,1-3H3,(H2,15,16,20)
InChIKey DYALFZWPHUNHCM-UHFFFAOYSA-N
Mol Weight 295.4 g/mol
Molecular Formula C14H21N3O2S
Exact Mass 295.135448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kl1AL0Mt8C4
Name methyl 4-[({[3-(dimethylamino)propyl]amino}carbothioyl)amino]benzoate
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/C14H21N3O2S/c1-17(2)10-4-9-15-14(20)16-12-7-5-11(6-8-12)13(18)19-3/h5-8H,4,9-10H2,1-3H3,(H2,15,16,20)
InChIKey DYALFZWPHUNHCM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2976
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: D06302; Labnumber: IVUSH-0487; SBI_ID: SBI-002978
Temperature 315 °C