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Diethyl (2Z)-2-[1-(2"-Oxopropyl)isoquinolin-2(1H)-yl]but-2-enedioate
SpectraBase Compound ID LyKUVBsB1aB
InChI InChI=1S/C20H23NO5/c1-4-25-19(23)13-18(20(24)26-5-2)21-11-10-15-8-6-7-9-16(15)17(21)12-14(3)22/h6-11,13,17H,4-5,12H2,1-3H3/b18-13-
InChIKey GHLGZRHXOOVHJH-AQTBWJFISA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JE6kjOkgEv
Name Diethyl (2Z)-2-[1-(2"-Oxopropyl)isoquinolin-2(1H)-yl]but-2-enedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-4-25-19(23)13-18(20(24)26-5-2)21-11-10-15-8-6-7-9-16(15)17(21)12-14(3)22/h6-11,13,17H,4-5,12H2,1-3H3/b18-13-
InChIKey GHLGZRHXOOVHJH-AQTBWJFISA-N
Molecular Weight 357.406 g/mol
SMILES C(\C=C\(N1C(c2ccccc2C=C1)CC(=O)C)C(=O)OCC)(=O)OCC
SPLASH splash10-0udi-1249000000-c56ebaef3a485d2a86b7
Source of Spectrum H-91-847-2b
Wiley ID 1693306