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N-[(4-bromophenyl)(phenyl)methyl]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
SpectraBase Compound ID 7zKCgQBMSYs
InChI InChI=1S/C24H19BrN2O3/c1-15(27-23(29)19-9-5-6-10-20(19)24(27)30)22(28)26-21(16-7-3-2-4-8-16)17-11-13-18(25)14-12-17/h2-15,21H,1H3,(H,26,28)
InChIKey OBTOTBSUBPXLHS-UHFFFAOYSA-N
Mol Weight 463.33 g/mol
Molecular Formula C24H19BrN2O3
Exact Mass 462.057905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lh7a6vozGu
Name N-[(4-Bromophenyl)(phenyl)methyl]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 462.057905477 u
Formula C24H19BrN2O3
InChI InChI=1S/C24H19BrN2O3/c1-15(27-23(29)19-9-5-6-10-20(19)24(27)30)22(28)26-21(16-7-3-2-4-8-16)17-11-13-18(25)14-12-17/h2-15,21H,1H3,(H,26,28)
InChIKey OBTOTBSUBPXLHS-UHFFFAOYSA-N
Molecular Weight 463.331 g/mol
SMILES N(C(C(N1C(C2=CC=CC=C2C1=O)=O)C)=O)C(C=1C=CC(=CC1)Br)C=1C=CC=CC1