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3-[4-(4-Hydroxyphenyl)-1-piperazinyl]-1-(3-methylphenyl)-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

3-[4-(4-Hydroxyphenyl)-1-piperazinyl]-1-(3-methylphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID 2NIOUeOdfeM
InChI InChI=1S/C21H23N3O3/c1-15-3-2-4-17(13-15)24-20(26)14-19(21(24)27)23-11-9-22(10-12-23)16-5-7-18(25)8-6-16/h2-8,13,19,25H,9-12,14H2,1H3
InChIKey NTQYPAUMVCEHHN-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FMVi3kFuUOk
Name 3-[4-(4-Hydroxyphenyl)-1-piperazinyl]-1-(3-methylphenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.173941610 u
Formula C21H23N3O3
InChI InChI=1S/C21H23N3O3/c1-15-3-2-4-17(13-15)24-20(26)14-19(21(24)27)23-11-9-22(10-12-23)16-5-7-18(25)8-6-16/h2-8,13,19,25H,9-12,14H2,1H3
InChIKey NTQYPAUMVCEHHN-UHFFFAOYSA-N
Molecular Weight 365.433 g/mol
SMILES OC=1C=CC(N2CCN(C3C(N(C(C3)=O)C3=CC(C)=CC=C3)=O)CC2)=CC1