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Thiophene-3-carboxylic acid, 2-benzoylaminothiocarbonylamino-4-ethyl-5-methyl-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Thiophene-3-carboxylic acid, 2-benzoylaminothiocarbonylamino-4-ethyl-5-methyl-, methyl ester
SpectraBase Compound ID LBWtpy4NJhD
InChI InChI=1S/C17H18N2O3S2/c1-4-12-10(2)24-15(13(12)16(21)22-3)19-17(23)18-14(20)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H2,18,19,20,23)
InChIKey KNJIEVUSPOCHMB-UHFFFAOYSA-N
Mol Weight 362.46 g/mol
Molecular Formula C17H18N2O3S2
Exact Mass 362.075885 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CI80kTj5ZQm
Name 3-thiophenecarboxylic acid, 2-[[(benzoylamino)carbonothioyl]amino]-4-ethyl-5-methyl-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.075884793 u
Formula C17H18N2O3S2
InChI InChI=1S/C17H18N2O3S2/c1-4-12-10(2)24-15(13(12)16(21)22-3)19-17(23)18-14(20)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H2,18,19,20,23)
InChIKey KNJIEVUSPOCHMB-UHFFFAOYSA-N
Molecular Weight 362.462 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11441
Solvent DMSO-d6
Source Vendor ID: NMR/10261425; Lab Info: AU; Lab Number: AU-ES01052