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(2E)-Methyl 3-(1-(1,3-dioxoisoindolin-2-yl)isoquinolin-2(1H)-yl)acrylate
SpectraBase Compound ID JvTKTUgho9F
InChI InChI=1S/C21H16N2O4/c1-27-18(24)11-13-22-12-10-14-6-2-3-7-15(14)19(22)23-20(25)16-8-4-5-9-17(16)21(23)26/h2-13,19H,1H3/b13-11+
InChIKey AMKHGXKXQVDTOX-ACCUITESSA-N
Mol Weight 360.37 g/mol
Molecular Formula C21H16N2O4
Exact Mass 360.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87w0vIKz0yS
Name (2E)-Methyl 3-(1-(1,3-dioxoisoindolin-2-yl)isoquinolin-2(1H)-yl)acrylate
Alternate Name(s) (E)-methyl 3-(1-(1,3-dioxoisoindolin-2-yl)isoquinolin-2(1H)-yl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O4
InChI InChI=1S/C21H16N2O4/c1-27-18(24)11-13-22-12-10-14-6-2-3-7-15(14)19(22)23-20(25)16-8-4-5-9-17(16)21(23)26/h2-13,19H,1H3/b13-11+
InChIKey AMKHGXKXQVDTOX-ACCUITESSA-N
Molecular Weight 360.369 g/mol
SMILES C1(N(C(c2ccccc12)=O)C1N(\C=C\C(=O)OC)C=Cc2c1cccc2)=O
SPLASH splash10-004i-0925000000-59939928b21649b2f73b
Source of Spectrum Y-51-1639-8i
Wiley ID 1741654