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Isoindole-1,3,5-trione, perhydro-6-methyl-2,7-diphenyl-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Isoindole-1,3,5-trione, perhydro-6-methyl-2,7-diphenyl-
SpectraBase Compound ID FU4Ifrn9x3S
InChI InChI=1S/C21H19NO3/c1-13-17(23)12-16-19(18(13)14-8-4-2-5-9-14)21(25)22(20(16)24)15-10-6-3-7-11-15/h2-11,13,16,18-19H,12H2,1H3
InChIKey KKXPDDJTUKQIDK-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C21H19NO3
Exact Mass 333.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ZxAVeosue8
Name Isoindole-1,3,5-trione, perhydro-6-methyl-2,7-diphenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.136493473 u
Formula C21H19NO3
InChI InChI=1S/C21H19NO3/c1-13-17(23)12-16-19(18(13)14-8-4-2-5-9-14)21(25)22(20(16)24)15-10-6-3-7-11-15/h2-11,13,16,18-19H,12H2,1H3
InChIKey KKXPDDJTUKQIDK-UHFFFAOYSA-N
Molecular Weight 333.387 g/mol
SMILES C1=CC=C(N2C(C3C(C(C)C(CC3C2=O)=O)C=2C=CC=CC2)=O)C=C1