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methyl 2-[(hexahydro-1H-azepin-1-ylcarbothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID 2RiOJl8teTo
InChI InChI=1S/C17H24N2O2S2/c1-21-16(20)14-12-8-4-5-9-13(12)23-15(14)18-17(22)19-10-6-2-3-7-11-19/h2-11H2,1H3,(H,18,22)
InChIKey LLVVJFMFHMZOEW-UHFFFAOYSA-N
Mol Weight 352.51 g/mol
Molecular Formula C17H24N2O2S2
Exact Mass 352.12792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B6sIr3Thahp
Name methyl 2-[(hexahydro-1H-azepin-1-ylcarbothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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/C17H24N2O2S2/c1-21-16(20)14-12-8-4-5-9-13(12)23-15(14)18-17(22)19-10-6-2-3-7-11-19/h2-11H2,1H3,(H,18,22)
InChIKey LLVVJFMFHMZOEW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7827
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: UZI/1268276; Labnumber: COL6195; UZI_ID: UZI-007829
Temperature 318 °C