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Ethyl 9-n-butyl-2-methyl-4,7-dioxo-4,6,7,11b-tetrahydro-3H-pyrimido[4,3-a]isoquinolin e-1-carboxylate
SpectraBase Compound ID 3wlNihcv2vP
InChI InChI=1S/C20H24N2O4/c1-4-6-7-13-8-9-14-15(10-13)16(23)11-22-18(14)17(19(24)26-5-2)12(3)21-20(22)25/h8-10,18H,4-7,11H2,1-3H3,(H,21,25)
InChIKey FDUFIGPYVWJIGV-UHFFFAOYSA-N
Mol Weight 356.42 g/mol
Molecular Formula C20H24N2O4
Exact Mass 356.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uMQdu07dmL
Name Ethyl 9-n-butyl-2-methyl-4,7-dioxo-4,6,7,11b-tetrahydro-3H-pyrimido[4,3-a]isoquinolin e-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O4
InChI InChI=1S/C20H24N2O4/c1-4-6-7-13-8-9-14-15(10-13)16(23)11-22-18(14)17(19(24)26-5-2)12(3)21-20(22)25/h8-10,18H,4-7,11H2,1-3H3,(H,21,25)
InChIKey FDUFIGPYVWJIGV-UHFFFAOYSA-N
Molecular Weight 356.422 g/mol
SMILES N1C(N2C(C(=C1C)C(=O)OCC)c1ccc(cc1C(C2)=O)CCCC)=O
SPLASH splash10-0pka-2927000000-0a71d6087cdb6ebd99b7
Source of Spectrum Y-48-1402-4h
Synonyms 9-Butyl-2-methyl-4,7-dioxo-6,11b-dihydro-3H-pyrimido[6,1-a]isoquinoline-1-carboxylic acid ethyl ester Ethyl 9-butyl-2-methyl-4,7-dioxo-6,11b-dihydro-3H-pyrimido[6,1-a]isoquinoline-1-carboxylate Ethyl 9-butyl-2-methyl-4,7-bis(oxidanylidene)-6,11b-dihydro-3H-pyrimido[6,1-a]isoquinoline-1-carboxylate
Wiley ID 1704465