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1-(1,3-Dihydro-isoindol-2-yl)-3-phenyl-propan-1,3-dione

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(1,3-Dihydro-isoindol-2-yl)-3-phenyl-propan-1,3-dione
SpectraBase Compound ID 9UKBhGYnity
InChI InChI=1S/C17H15NO2/c19-16(13-6-2-1-3-7-13)10-17(20)18-11-14-8-4-5-9-15(14)12-18/h1-9H,10-12H2
InChIKey GFMBLRMINOLVES-UHFFFAOYSA-N
Mol Weight 265.31 g/mol
Molecular Formula C17H15NO2
Exact Mass 265.110279 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A4MWCuNtdfm
Name 1-(1,3-Dihydro-isoindol-2-yl)-3-phenyl-propan-1,3-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 265.110278725 u
Formula C17H15NO2
InChI InChI=1S/C17H15NO2/c19-16(13-6-2-1-3-7-13)10-17(20)18-11-14-8-4-5-9-15(14)12-18/h1-9H,10-12H2
InChIKey GFMBLRMINOLVES-UHFFFAOYSA-N
Molecular Weight 265.312 g/mol
SMILES C1(=CC=CC=C1)C(=O)CC(=O)N1CC2=CC=CC=C2C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925368