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(2E,6E)-2,6-bis[(5-bromo-2-thienyl)methylene]-4-methylcyclohexanone
SpectraBase Compound ID HzhsYv11cEl
InChI InChI=1S/C17H14Br2OS2/c1-10-6-11(8-13-2-4-15(18)21-13)17(20)12(7-10)9-14-3-5-16(19)22-14/h2-5,8-10H,6-7H2,1H3/b11-8+,12-9+
InChIKey XYANYVOXWOZGSE-HZOWPXDZSA-N
Mol Weight 458.23 g/mol
Molecular Formula C17H14Br2OS2
Exact Mass 455.885283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4oS4IGpzgSy
Name (2E,6E)-2,6-bis[(5-bromo-2-thienyl)methylene]-4-methylcyclohexanone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 455.885283418 u
Formula C17H14Br2OS2
InChI InChI=1S/C17H14Br2OS2/c1-10-6-11(8-13-2-4-15(18)21-13)17(20)12(7-10)9-14-3-5-16(19)22-14/h2-5,8-10H,6-7H2,1H3/b11-8+,12-9+
InChIKey XYANYVOXWOZGSE-HZOWPXDZSA-N
Molecular Weight 458.226 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3220
Solvent DMSO-d6
Source Vendor ID: NMR/12288627