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N-(3-Cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-4-nitrobenzamide

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

N-(3-Cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)-4-nitrobenzamide
SpectraBase Compound ID KXzn4TtTfh2
InChI InChI=1S/C16H13N3O3S/c17-9-13-12-3-1-2-4-14(12)23-16(13)18-15(20)10-5-7-11(8-6-10)19(21)22/h5-8H,1-4H2,(H,18,20)
InChIKey DBPXHLRHLJGVLN-UHFFFAOYSA-N
Mol Weight 327.36 g/mol
Molecular Formula C16H13N3O3S
Exact Mass 327.067762 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CoezBXwDEBN
Name benzamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-4-nitro-
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/C16H13N3O3S/c17-9-13-12-3-1-2-4-14(12)23-16(13)18-15(20)10-5-7-11(8-6-10)19(21)22/h5-8H,1-4H2,(H,18,20)
InChIKey DBPXHLRHLJGVLN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2679
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: AG-205/5110695; Labnumber: DK4-100; IOH_ID: IOH-009682