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Dimethyl 2-(1-(1,3-dioxo-1,3-diphenylpropan-2-yl)isoquinolin-2(1H)-yl)maleate
SpectraBase Compound ID BycUN0fKYqs
InChI InChI=1S/C30H25NO6/c1-36-25(32)19-24(30(35)37-2)31-18-17-20-11-9-10-16-23(20)27(31)26(28(33)21-12-5-3-6-13-21)29(34)22-14-7-4-8-15-22/h3-19,26-27H,1-2H3/b24-19+
InChIKey XBMSZHJGCFSBCW-LYBHJNIJSA-N
Mol Weight 495.53 g/mol
Molecular Formula C30H25NO6
Exact Mass 495.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIHDYrO3IOy
Name Dimethyl 2-(1-(1,3-dioxo-1,3-diphenylpropan-2-yl)isoquinolin-2(1H)-yl)maleate
Appearance Brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25NO6
InChI InChI=1S/C30H25NO6/c1-36-25(32)19-24(30(35)37-2)31-18-17-20-11-9-10-16-23(20)27(31)26(28(33)21-12-5-3-6-13-21)29(34)22-14-7-4-8-15-22/h3-19,26-27H,1-2H3/b24-19+
InChIKey XBMSZHJGCFSBCW-LYBHJNIJSA-N
Instrument Name GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.205
Molecular Weight 495.531 g/mol
SMILES COC(\C(=C/C(=O)OC)N1C(c2c(C=C1)cccc2)C(C(=O)c1ccccc1)C(c1ccccc1)=O)=O
SPLASH splash10-004i-1900000000-99dbdf587b21fc92ca34
Source of Spectrum ARK-2010-68-8j
Wiley ID 1866807