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3-(2-hydroxyphenyl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
SpectraBase Compound ID JwUVfbVjEHy
InChI InChI=1S/C26H24N2O5/c1-2-16-32-19-14-12-17(13-15-19)27-25(30)22-23(20-10-6-7-11-21(20)29)28(33-24(22)26(27)31)18-8-4-3-5-9-18/h3-15,22-24,29H,2,16H2,1H3
InChIKey PWGSGXKGZUSYKQ-UHFFFAOYSA-N
Mol Weight 444.49 g/mol
Molecular Formula C26H24N2O5
Exact Mass 444.168522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Go6GMf7dai3
Name 3-(2-Hydroxyphenyl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-D]isoxazole-4,6(3H,5H)-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.168521876 u
Formula C26H24N2O5
InChI InChI=1S/C26H24N2O5/c1-2-16-32-19-14-12-17(13-15-19)27-25(30)22-23(20-10-6-7-11-21(20)29)28(33-24(22)26(27)31)18-8-4-3-5-9-18/h3-15,22-24,29H,2,16H2,1H3
InChIKey PWGSGXKGZUSYKQ-UHFFFAOYSA-N
Molecular Weight 444.487 g/mol
SMILES OC=1C(C2C3C(C(N(C=4C=CC(=CC4)OCCC)C3=O)=O)ON2C=2C=CC=CC2)=CC=CC1