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1-(4-Butoxyphenyl)-3-(4-thiomorpholinyl)-2,5-pyrrolidinedione

View entire compound with spectra: 3 NMR

1-(4-Butoxyphenyl)-3-(4-thiomorpholinyl)-2,5-pyrrolidinedione
SpectraBase Compound ID HPmCUndg75y
InChI InChI=1S/C18H24N2O3S/c1-2-3-10-23-15-6-4-14(5-7-15)20-17(21)13-16(18(20)22)19-8-11-24-12-9-19/h4-7,16H,2-3,8-13H2,1H3
InChIKey KGOWVZDALVBALO-UHFFFAOYSA-N
Mol Weight 348.46 g/mol
Molecular Formula C18H24N2O3S
Exact Mass 348.150764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COF4Pb7iMQR
Name 1-(4-Butoxyphenyl)-3-(4-thiomorpholinyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.150763812 u
Formula C18H24N2O3S
InChI InChI=1S/C18H24N2O3S/c1-2-3-10-23-15-6-4-14(5-7-15)20-17(21)13-16(18(20)22)19-8-11-24-12-9-19/h4-7,16H,2-3,8-13H2,1H3
InChIKey KGOWVZDALVBALO-UHFFFAOYSA-N
Molecular Weight 348.461 g/mol
SMILES CCCCOC=1C=CC(N2C(C(N3CCSCC3)CC2=O)=O)=CC1