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cyclohexanone, 4-ethyl-2,6-bis(2-thienylmethylene)-, (2E,6E)-
SpectraBase Compound ID 6Q5DTxZkN5P
InChI InChI=1S/C18H18OS2/c1-2-13-9-14(11-16-5-3-7-20-16)18(19)15(10-13)12-17-6-4-8-21-17/h3-8,11-13H,2,9-10H2,1H3/b14-11+,15-12+
InChIKey TVRQQLBTOYAMMD-LCPPQYOVSA-N
Mol Weight 314.46 g/mol
Molecular Formula C18H18OS2
Exact Mass 314.079908 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D2rzPwlGMgw
Name cyclohexanone, 4-ethyl-2,6-bis(2-thienylmethylene)-, (2E,6E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.079907547 u
Formula C18H18OS2
InChI InChI=1S/C18H18OS2/c1-2-13-9-14(11-16-5-3-7-20-16)18(19)15(10-13)12-17-6-4-8-21-17/h3-8,11-13H,2,9-10H2,1H3/b14-11+,15-12+
InChIKey TVRQQLBTOYAMMD-LCPPQYOVSA-N
Molecular Weight 314.461 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_554
Solvent DMSO-d6
Source Vendor ID: NMR/13239055