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3-(2-Benzyl-3-oxoisoindolin-1-yl)pentane-2,4-dione

View entire compound with spectra: 1 MS (GC)

3-(2-Benzyl-3-oxoisoindolin-1-yl)pentane-2,4-dione
SpectraBase Compound ID IVuKHWn5bE9
InChI InChI=1S/C20H19NO3/c1-13(22)18(14(2)23)19-16-10-6-7-11-17(16)20(24)21(19)12-15-8-4-3-5-9-15/h3-11,18-19H,12H2,1-2H3
InChIKey WVVATHQSPAMENP-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hda2rmxnc
Name 3-(2-Benzyl-3-oxoisoindolin-1-yl)pentane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-13(22)18(14(2)23)19-16-10-6-7-11-17(16)20(24)21(19)12-15-8-4-3-5-9-15/h3-11,18-19H,12H2,1-2H3
InChIKey WVVATHQSPAMENP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo4015886
Molecular Weight 321.376 g/mol
SMILES c1ccc2C(C(C(=O)C)C(=O)C)N(C(=O)c2c1)Cc1ccccc1
SPLASH splash10-0019-1790000000-3c8dd7a1f675692239a3
Source of Spectrum J-79-1909-VD
Wiley ID 1745782