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Dimethyl 5-(1,1-dichloro-5-cyanopentyl)cyclopenta[c]pyridine-2,2-dicarboxylate
SpectraBase Compound ID HcCQuN918Ad
InChI InChI=1S/C18H20Cl2N2O4/c1-25-15(23)17(16(24)26-2)9-12-8-14(22-11-13(12)10-17)18(19,20)6-4-3-5-7-21/h8,11H,3-6,9-10H2,1-2H3
InChIKey DGWLSKBOGQXMAL-UHFFFAOYSA-N
Mol Weight 399.27 g/mol
Molecular Formula C18H20Cl2N2O4
Exact Mass 398.080013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZyZmf8cdxS
Name Dimethyl 5-(1,1-dichloro-5-cyanopentyl)cyclopenta[c]pyridine-2,2-dicarboxylate
Alternate Name(s) Dimethyl 3-(1,1-dichloro-5-cyanopentyl)-5,7-dihydro-6H-cyclopenta[c]pyridine-6,6-dicarboxylate
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Formula C18H20Cl2N2O4
InChI InChI=1S/C18H20Cl2N2O4/c1-25-15(23)17(16(24)26-2)9-12-8-14(22-11-13(12)10-17)18(19,20)6-4-3-5-7-21/h8,11H,3-6,9-10H2,1-2H3
InChIKey DGWLSKBOGQXMAL-UHFFFAOYSA-N
Molecular Weight 399.274 g/mol
SMILES C1(Cc2cc(C(Cl)(Cl)CCCCC#N)ncc2C1)(C(=O)OC)C(=O)OC
SPLASH splash10-014i-0009000000-7009592f3ffa4a43cb68
Source of Spectrum QE-12-5628-4
Wiley ID 1587133