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2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione, 3-(2-furanyl)dihydro-5-(4-methylphenyl)-2-phenyl-
SpectraBase Compound ID 1lLDudK7xO4
InChI InChI=1S/C22H18N2O4/c1-14-9-11-15(12-10-14)23-21(25)18-19(17-8-5-13-27-17)24(28-20(18)22(23)26)16-6-3-2-4-7-16/h2-13,18-20H,1H3
InChIKey NWAYJQLHBBIFSC-UHFFFAOYSA-N
Mol Weight 374.4 g/mol
Molecular Formula C22H18N2O4
Exact Mass 374.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HDVua4iR6DS
Name 2H-Pyrrolo[3,4-D]isoxazole-4,6(3H,5H)-dione, 3-(2-furanyl)dihydro-5-(4-methylphenyl)-2-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.126657064 u
Formula C22H18N2O4
InChI InChI=1S/C22H18N2O4/c1-14-9-11-15(12-10-14)23-21(25)18-19(17-8-5-13-27-17)24(28-20(18)22(23)26)16-6-3-2-4-7-16/h2-13,18-20H,1H3
InChIKey NWAYJQLHBBIFSC-UHFFFAOYSA-N
Molecular Weight 374.396 g/mol
SMILES C12C(C(=O)N(C2=O)C=2C=CC(=CC2)C)ON(C1C=1OC=CC1)C=1C=CC=CC1