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1-(4-Bromophenyl)-3-[(2-methoxyphenyl)sulfanyl]-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

1-(4-Bromophenyl)-3-[(2-methoxyphenyl)sulfanyl]-2,5-pyrrolidinedione
SpectraBase Compound ID 9W0mr7Ccmo6
InChI InChI=1S/C17H14BrNO3S/c1-22-13-4-2-3-5-14(13)23-15-10-16(20)19(17(15)21)12-8-6-11(18)7-9-12/h2-9,15H,10H2,1H3
InChIKey PTMYRGQUYYVKSG-UHFFFAOYSA-N
Mol Weight 392.27 g/mol
Molecular Formula C17H14BrNO3S
Exact Mass 390.987777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMmF4vAzDBu
Name 1-(4-Bromophenyl)-3-[(2-methoxyphenyl)sulfanyl]-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.987777486 u
Formula C17H14BrNO3S
InChI InChI=1S/C17H14BrNO3S/c1-22-13-4-2-3-5-14(13)23-15-10-16(20)19(17(15)21)12-8-6-11(18)7-9-12/h2-9,15H,10H2,1H3
InChIKey PTMYRGQUYYVKSG-UHFFFAOYSA-N
Molecular Weight 392.267 g/mol
SMILES C=1C=CC(SC2C(N(C(C2)=O)C2=CC=C(C=C2)Br)=O)=C(OC)C1