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1-[(2E)-3-(2-thienyl)-2-propenoyl]hexahydro-1H-azepine

View entire compound with spectra: 1 NMR

1-[(2E)-3-(2-thienyl)-2-propenoyl]hexahydro-1H-azepine
SpectraBase Compound ID 61CF3ymLXxl
InChI InChI=1S/C13H17NOS/c15-13(8-7-12-6-5-11-16-12)14-9-3-1-2-4-10-14/h5-8,11H,1-4,9-10H2/b8-7+
InChIKey PIOLTVRSDIIZLW-BQYQJAHWSA-N
Mol Weight 235.34 g/mol
Molecular Formula C13H17NOS
Exact Mass 235.103085 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DL2fKlTa44X
Name 1-[(2E)-3-(2-thienyl)-2-propenoyl]hexahydro-1H-azepine
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/C13H17NOS/c15-13(8-7-12-6-5-11-16-12)14-9-3-1-2-4-10-14/h5-8,11H,1-4,9-10H2/b8-7+
InChIKey PIOLTVRSDIIZLW-BQYQJAHWSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1918
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/8036188; UBI_ID: UBI-001919
Synonyms 1-[3-(2-thienyl)-2-propenoyl]hexahydro-1H-azepine
Temperature 313 °C