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Cyclopent[de]isoquinoline-4,5-dicarboxylic acid, 2,3-dihydro-2-methyl-3-oxo-, dimethyl ester
SpectraBase Compound ID EAjZP8bvfjx
InChI InChI=1S/C16H13NO5/c1-17-7-8-5-4-6-9-10(8)12(14(17)18)13(16(20)22-3)11(9)15(19)21-2/h4-7H,1-3H3
InChIKey IFYFIKGVMZLKJH-UHFFFAOYSA-N
Mol Weight 299.28 g/mol
Molecular Formula C16H13NO5
Exact Mass 299.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63IqIzPxTWD
Name Cyclopent[de]isoquinoline-4,5-dicarboxylic acid, 2,3-dihydro-2-methyl-3-oxo-, dimethyl ester
Alternate Name(s) Dimethyl 2-methyl-2,3-dihydro-3-oxocyclopent[de]isoquinoline-4,5-dicarboxylate Dimethyl 2-methyl-3-oxo-2,3-dihydrocyclopenta[de]isoquinoline-4,5-dicarboxylate
CAS Registry Number 113280-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO5
InChI InChI=1S/C16H13NO5/c1-17-7-8-5-4-6-9-10(8)12(14(17)18)13(16(20)22-3)11(9)15(19)21-2/h4-7H,1-3H3
InChIKey IFYFIKGVMZLKJH-UHFFFAOYSA-N
Molecular Weight 299.282 g/mol
SMILES C12=C3C(C(=O)OC)=C(C2=CC=CC1=CN(C)C3=O)C(=O)OC
SPLASH splash10-00l2-0591000000-c2d89e557e3b29f0d2d0
Source of Spectrum AJ-61-1228-3
Wiley ID 1301928