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2-Benzyl-3-(4-nitrophenyl)isoindolin-1-one
SpectraBase Compound ID KGnuexNGIfd
InChI InChI=1S/C21H16N2O3/c24-21-19-9-5-4-8-18(19)20(16-10-12-17(13-11-16)23(25)26)22(21)14-15-6-2-1-3-7-15/h1-13,20H,14H2
InChIKey WTEJVSDOJDMVKH-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C21H16N2O3
Exact Mass 344.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3dH5DE0Eve
Name 2-Benzyl-3-(4-nitrophenyl)isoindolin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O3
InChI InChI=1S/C21H16N2O3/c24-21-19-9-5-4-8-18(19)20(16-10-12-17(13-11-16)23(25)26)22(21)14-15-6-2-1-3-7-15/h1-13,20H,14H2
InChIKey WTEJVSDOJDMVKH-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol202271k
Molecular Weight 344.370 g/mol
SMILES C1(N(C(=O)c2ccccc12)Cc1ccccc1)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0006-9534000000-e9ff61251636b13cc0d9
Source of Spectrum A1-13-5374/SM8-8i
Wiley ID 1753841