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4-piperidinone, 3,5-bis[(4-bromo-2-thienyl)methylene]-1-(phenylmethyl)-, (3E,5E)-
SpectraBase Compound ID CJPH6dHZ4Q
InChI InChI=1S/C22H17Br2NOS2/c23-18-8-20(27-13-18)6-16-11-25(10-15-4-2-1-3-5-15)12-17(22(16)26)7-21-9-19(24)14-28-21/h1-9,13-14H,10-12H2/b16-6+,17-7+
InChIKey FMIMZIFKPWDJGE-KGMKFKQSSA-N
Mol Weight 535.31 g/mol
Molecular Formula C22H17Br2NOS2
Exact Mass 532.911833 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID uj8c8qbQkv
Name 4-piperidinone, 3,5-bis[(4-bromo-2-thienyl)methylene]-1-(phenylmethyl)-, (3E,5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 532.911832518 u
Formula C22H17Br2NOS2
InChI InChI=1S/C22H17Br2NOS2/c23-18-8-20(27-13-18)6-16-11-25(10-15-4-2-1-3-5-15)12-17(22(16)26)7-21-9-19(24)14-28-21/h1-9,13-14H,10-12H2/b16-6+,17-7+
InChIKey FMIMZIFKPWDJGE-KGMKFKQSSA-N
Molecular Weight 535.312 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3910
Solvent DMSO-d6
Source Vendor ID: NMR/13279282