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(3E,5E)-3,5-bis[(5-bromo-2-thienyl)methylene]-1-methyl-4-piperidinone
SpectraBase Compound ID BHCwBnrvxyc
InChI InChI=1S/C16H13Br2NOS2/c1-19-8-10(6-12-2-4-14(17)21-12)16(20)11(9-19)7-13-3-5-15(18)22-13/h2-7H,8-9H2,1H3/b10-6+,11-7+
InChIKey FLGBRDBTESGZJW-JMQWPVDRSA-N
Mol Weight 459.21 g/mol
Molecular Formula C16H13Br2NOS2
Exact Mass 456.880532 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4jhyfrQW0He
Name (3E,5E)-3,5-bis[(5-bromo-2-thienyl)methylene]-1-methyl-4-piperidinone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 456.880532390 u
Formula C16H13Br2NOS2
InChI InChI=1S/C16H13Br2NOS2/c1-19-8-10(6-12-2-4-14(17)21-12)16(20)11(9-19)7-13-3-5-15(18)22-13/h2-7H,8-9H2,1H3/b10-6+,11-7+
InChIKey FLGBRDBTESGZJW-JMQWPVDRSA-N
Molecular Weight 459.214 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3218
Solvent DMSO-d6
Source Vendor ID: NMR/12288625