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1,3(2H)-Quinolinedicarboxylic acid, 4-hydroxy-2-[4-(methoxy)-2,4-dioxobutyl]-, diethyl ester, (.+-.)-
SpectraBase Compound ID 5s4Cn6KqRV7
InChI InChI=1S/C20H23NO8/c1-4-28-19(25)17-15(10-12(22)11-16(23)27-3)21(20(26)29-5-2)14-9-7-6-8-13(14)18(17)24/h6-9,15,24H,4-5,10-11H2,1-3H3
InChIKey VPGJOKZPLQGKIR-UHFFFAOYSA-N
Mol Weight 405.4 g/mol
Molecular Formula C20H23NO8
Exact Mass 405.142367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EW1rHjcCL3o
Name 1,3(2H)-Quinolinedicarboxylic acid, 4-hydroxy-2-[4-(methoxy)-2,4-dioxobutyl]-, diethyl ester, (.+-.)-
Alternate Name(s) 1,3-Bisethoxycarbonyl-4-hydro-2-[2-oxo-3-carbomethoxy]propyl-1,2-dihydroquinoline Diethyl 4-hydroxy-2-(4-methoxy-2,4-dioxobutyl)-1,3(2H)-quinolinedicarboxylate
CAS Registry Number 125836-18-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO8
InChI InChI=1S/C20H23NO8/c1-4-28-19(25)17-15(10-12(22)11-16(23)27-3)21(20(26)29-5-2)14-9-7-6-8-13(14)18(17)24/h6-9,15,24H,4-5,10-11H2,1-3H3
InChIKey VPGJOKZPLQGKIR-UHFFFAOYSA-N
Molecular Weight 405.403 g/mol
SMILES OC1=C(C(N(c2ccccc12)C(=O)OCC)CC(CC(=O)OC)=O)C(=O)OCC
SPLASH splash10-000i-0190000000-d2b1c2bb21369865ee8d
Source of Spectrum F-45-901-17
Wiley ID 1371699