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4-methyl-N-phenylhexahydro-1H-1,4-diazepine-1-carbothioamide

View entire compound with spectra: 1 NMR

4-methyl-N-phenylhexahydro-1H-1,4-diazepine-1-carbothioamide
SpectraBase Compound ID EhRKVEYinFu
InChI InChI=1S/C13H19N3S/c1-15-8-5-9-16(11-10-15)13(17)14-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,14,17)
InChIKey PGVMVHWHRGEMRC-UHFFFAOYSA-N
Mol Weight 249.38 g/mol
Molecular Formula C13H19N3S
Exact Mass 249.129969 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID iO0oCU5RnH
Name 4-methyl-N-phenylhexahydro-1H-1,4-diazepine-1-carbothioamide
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/C13H19N3S/c1-15-8-5-9-16(11-10-15)13(17)14-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,14,17)
InChIKey PGVMVHWHRGEMRC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_775
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/8297108; Labnumber: XXX; IOH_ID: IOH-000776
Temperature 303 °C